#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xck n ALA 3 N 0.00 1.84 -2.37 0.00 0.00 -1.26 -4.96 120.51 113.77 1xck n ALA 3 Ca 0.00 0.43 -0.20 0.00 0.00 0.00 0.00 53.44 53.67 1xck n ALA 3 Cb 0.00 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.02 1xck n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xck s LYS 4 N 0.92 2.79 -0.23 0.00 -0.14 -1.26 -3.10 119.74 118.72 1xck s LYS 4 Ca 0.77 -1.27 0.01 0.00 -1.36 0.00 0.00 55.97 54.12 1xck s LYS 4 Cb -0.62 -2.57 0.04 0.00 -1.68 0.00 0.00 37.83 32.99 1xck s LYS 4 CO 0.37 -0.02 -0.13 0.34 -0.76 0.00 0.00 175.35 175.14 1xck s ASP 5 N -4.11 3.92 -0.17 2.83 -1.08 0.55 -4.77 116.67 113.82 1xck s ASP 5 Ca 0.45 -1.00 -0.04 0.00 -0.52 0.00 0.00 52.55 51.45 1xck s ASP 5 Cb -0.07 -1.55 -0.02 0.00 -1.46 0.00 0.00 42.92 39.82 1xck s ASP 5 CO 0.29 -0.10 -0.04 -0.69 0.52 0.00 0.00 175.17 175.15 1xck s VAL 6 N 1.22 3.77 0.11 1.11 1.01 -1.26 -2.17 120.40 124.19 1xck s VAL 6 Ca -0.02 -0.39 0.09 0.00 0.00 0.00 0.00 61.98 61.66 1xck s VAL 6 Cb -0.17 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1xck s VAL 6 CO -0.08 0.47 -0.18 -0.54 0.00 0.00 0.00 175.10 174.77 1xck s LYS 7 N 0.66 1.82 0.35 2.72 1.02 -0.39 -4.98 119.74 120.93 1xck s LYS 7 Ca -0.02 -1.16 0.08 0.00 0.02 0.00 0.00 55.97 54.89 1xck s LYS 7 Cb -0.14 -2.12 -0.07 0.00 -0.52 0.00 0.00 37.83 34.98 1xck s LYS 7 CO 0.02 0.49 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.82 1xck s PHE 8 N -1.12 2.32 0.00 3.18 0.08 -1.26 -1.32 117.98 119.86 1xck s PHE 8 Ca 0.18 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.63 1xck s PHE 8 Cb -0.11 -1.41 0.00 0.00 -0.57 0.00 0.00 43.02 40.93 1xck s PHE 8 CO 0.10 0.47 0.00 0.41 -0.10 0.00 0.00 175.22 176.09 1xck n GLY 9 N -0.79 0.68 0.35 4.36 0.00 0.82 -1.47 105.19 109.15 1xck n GLY 9 Ca -0.05 0.07 0.03 0.00 0.00 0.00 0.00 46.02 46.07 1xck n GLY 9 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1xck h ASN 10 N 0.00 0.94 -0.93 1.61 -0.73 -1.93 -0.35 115.58 114.19 1xck h ASN 10 Ca 0.00 0.02 0.04 0.00 1.87 0.00 0.00 56.30 58.23 1xck h ASN 10 Cb 0.00 -0.18 -0.06 0.00 0.27 0.00 0.00 38.32 38.36 1xck h ASN 10 CO 0.00 0.59 0.60 -0.78 -0.37 0.00 0.00 177.43 177.46 1xck h ASP 11 N 1.07 0.99 -0.28 1.15 -0.00 -1.82 -1.73 116.42 115.81 1xck h ASP 11 Ca 0.42 -0.00 -0.13 0.00 -0.00 0.00 0.00 57.03 57.32 1xck h ASP 11 Cb 0.22 -0.22 -0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1xck h ASP 11 CO -0.19 0.67 -0.33 0.00 -0.00 0.00 0.00 179.24 179.40 1xck h ALA 12 N 1.39 0.41 -0.45 -0.78 0.00 -0.05 -3.18 119.26 116.60 1xck h ALA 12 Ca 0.37 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1xck h ALA 12 Cb 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1xck h ALA 12 CO -0.13 0.46 -0.10 0.00 0.00 0.00 0.00 179.25 179.48 1xck h ARG 13 N 0.45 0.82 -0.61 0.00 3.08 -0.76 -2.37 114.38 115.00 1xck h ARG 13 Ca 0.04 -0.27 -0.09 0.00 0.07 0.00 0.00 59.98 59.72 1xck h ARG 13 Cb 0.90 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 1xck h ARG 13 CO 0.08 0.89 0.03 -0.39 -1.07 0.00 0.00 179.97 179.51 1xck h VAL 14 N 0.74 1.26 -0.08 2.04 -1.51 -1.40 -0.90 116.25 116.41 1xck h VAL 14 Ca 0.13 -1.11 0.03 0.00 -1.23 0.00 0.00 66.70 64.51 1xck h VAL 14 Cb 0.59 0.76 -0.03 0.00 -2.13 0.00 0.00 31.29 30.48 1xck h VAL 14 CO 0.04 0.41 -0.12 0.11 -1.23 0.00 0.00 177.57 176.78 1xck h LYS 15 N 0.97 -0.15 -0.28 5.19 1.79 -1.50 0.19 116.57 122.77 1xck h LYS 15 Ca 0.18 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.69 1xck h LYS 15 Cb 0.52 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 1xck h LYS 15 CO 0.02 -0.10 0.10 0.52 -1.08 0.00 0.00 179.45 178.92 1xck h MET 16 N -0.16 0.23 -0.01 3.15 2.86 -1.16 -0.94 114.93 118.90 1xck h MET 16 Ca 0.07 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.71 1xck h MET 16 Cb 0.26 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1xck h MET 16 CO -0.17 0.15 -0.10 1.25 1.06 0.00 0.00 176.91 179.10 1xck h LEU 17 N 0.23 -0.28 -1.12 1.22 5.85 -0.73 0.15 115.31 120.64 1xck h LEU 17 Ca 0.12 0.04 0.18 0.00 0.84 0.00 0.00 57.88 59.07 1xck h LEU 17 Cb 0.08 0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.14 1xck h LEU 17 CO -0.12 -0.14 0.61 -0.09 -0.34 0.00 0.00 178.44 178.36 1xck h ARG 18 N -0.16 0.71 0.07 1.25 9.65 -0.38 0.13 114.38 125.65 1xck h ARG 18 Ca 0.04 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1xck h ARG 18 Cb 0.21 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 1xck h ARG 18 CO -0.10 0.47 -0.03 0.78 2.80 0.00 0.00 179.97 183.88 1xck h GLY 19 N 0.73 -0.10 2.00 2.80 0.00 -0.21 -2.96 103.07 105.34 1xck h GLY 19 Ca 0.54 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.89 1xck h GLY 19 CO -0.31 -0.03 -0.06 -0.39 0.00 0.00 0.00 176.54 175.74 1xck h VAL 20 N -0.56 0.25 -0.36 4.60 -1.51 -0.06 -2.40 116.25 116.21 1xck h VAL 20 Ca -0.01 -0.46 -0.09 0.00 -1.23 0.00 0.00 66.70 64.91 1xck h VAL 20 Cb 0.48 1.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.99 1xck h VAL 20 CO 0.02 0.06 -0.11 0.78 -1.23 0.00 0.00 177.57 177.08 1xck h ASN 21 N 0.00 0.73 -0.19 4.19 2.35 -0.71 0.34 115.58 122.30 1xck h ASN 21 Ca -0.00 -0.38 0.02 0.00 -0.55 0.00 0.00 56.30 55.39 1xck h ASN 21 Cb 0.36 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1xck h ASN 21 CO 0.01 0.94 0.06 0.58 -1.65 0.00 0.00 177.43 177.37 1xck h VAL 22 N 0.51 0.95 0.55 2.81 2.07 -1.27 0.20 116.25 122.07 1xck h VAL 22 Ca 0.09 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 1xck h VAL 22 Cb 0.63 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1xck h VAL 22 CO 0.04 0.03 -0.34 0.25 0.02 0.00 0.00 177.57 177.57 1xck h LEU 23 N 0.15 -0.85 -0.19 2.57 5.85 -1.31 -2.18 115.31 119.36 1xck h LEU 23 Ca 0.08 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1xck h LEU 23 Cb 0.05 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1xck h LEU 23 CO -0.08 -0.53 0.05 0.00 -0.34 0.00 0.00 178.44 177.54 1xck h ALA 24 N -0.45 0.20 -0.46 1.25 0.00 -0.13 -2.07 119.26 117.60 1xck h ALA 24 Ca -0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xck h ALA 24 Cb 0.68 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1xck h ALA 24 CO 0.07 -0.38 0.23 -0.44 0.00 0.00 0.00 179.25 178.72 1xck h ASP 25 N 0.13 0.56 -0.25 0.00 3.32 -0.60 0.19 116.42 119.78 1xck h ASP 25 Ca 0.08 -0.04 -0.16 0.00 0.02 0.00 0.00 57.03 56.93 1xck h ASP 25 Cb 0.07 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 1xck h ASP 25 CO -0.10 0.48 -0.46 0.00 -1.72 0.00 0.00 179.24 177.44 1xck h ALA 26 N 1.62 0.60 0.23 3.45 0.00 -1.10 -3.32 119.26 120.74 1xck h ALA 26 Ca 0.16 -0.48 -0.31 0.00 0.00 0.00 0.00 54.91 54.28 1xck h ALA 26 Cb 0.05 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.78 1xck h ALA 26 CO -0.02 0.68 -1.39 0.28 0.00 0.00 0.00 179.25 178.79 1xck h VAL 27 N 0.65 1.29 0.00 0.00 2.07 -0.94 -3.37 116.25 115.96 1xck h VAL 27 Ca 0.04 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.90 1xck h VAL 27 Cb 1.04 3.05 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1xck h VAL 27 CO 0.10 0.80 0.00 0.07 0.02 0.00 0.00 177.57 178.56 1xck h LYS 28 N 0.05 0.00 0.00 1.57 2.10 -0.74 -2.75 116.57 116.81 1xck h LYS 28 Ca -0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 1xck h LYS 28 Cb 2.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.41 1xck h LYS 28 CO 0.25 0.00 0.00 -0.39 -2.00 0.00 0.00 179.45 177.31 1xck h VAL 29 N 0.00 0.00 -0.49 0.07 -1.51 -1.72 -2.83 116.25 109.77 1xck h VAL 29 Ca 0.00 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1xck h VAL 29 Cb 0.34 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1xck h VAL 29 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 1xck n THR 30 N -3.03 1.59 0.00 7.19 -2.24 -1.04 -0.79 114.28 115.96 1xck n THR 30 Ca 0.00 -0.95 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 1xck n THR 30 Cb 0.28 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1xck n THR 30 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1xck n LEU 31 N 0.75 0.85 -4.28 3.22 7.94 -1.07 -4.67 117.00 119.75 1xck n LEU 31 Ca 0.20 0.45 -0.30 0.00 -1.11 0.00 0.00 56.01 55.25 1xck n LEU 31 Cb 0.78 -0.30 0.29 0.00 0.53 0.00 0.00 43.42 44.72 1xck n LEU 31 CO 0.20 -0.30 0.38 0.61 -1.11 0.00 0.00 177.39 177.17 1xck n GLY 32 N 1.32 -3.47 0.00 -3.96 0.00 -1.26 -4.64 105.19 93.18 1xck n GLY 32 Ca 0.00 -1.57 0.08 0.00 0.00 0.00 0.00 46.02 44.53 1xck n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xck n PRO 33 N -5.59 0.44 -0.51 1.61 -0.04 -1.26 0.16 135.00 129.81 1xck n PRO 33 Ca 0.11 0.03 0.04 0.00 -0.04 0.00 0.00 63.50 63.64 1xck n PRO 33 Cb 0.59 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.75 1xck n PRO 33 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1xck n LYS 34 N -1.06 2.02 -1.71 0.54 4.76 -1.26 -5.02 118.16 116.42 1xck n LYS 34 Ca 0.11 -2.97 -0.37 0.00 -2.87 0.00 0.00 58.31 52.21 1xck n LYS 34 Cb 0.07 -1.73 0.07 0.00 -1.84 0.00 0.00 35.03 31.60 1xck n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xck n GLY 35 N -1.01 0.43 3.98 0.72 0.00 0.12 -4.60 105.19 104.84 1xck n GLY 35 Ca 0.24 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1xck n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck s ARG 36 N -3.29 2.25 0.05 1.61 1.81 0.03 -4.93 118.95 116.48 1xck s ARG 36 Ca 0.82 -0.97 -0.09 0.00 -1.72 0.00 0.00 55.73 53.77 1xck s ARG 36 Cb -0.38 -2.46 -0.05 0.00 -0.45 0.00 0.00 34.95 31.60 1xck s ARG 36 CO 0.41 -0.95 0.35 -0.80 -0.68 0.00 0.00 175.30 173.63 1xck s ASN 37 N -4.54 6.59 -0.07 0.23 0.02 -1.26 -4.33 114.94 111.58 1xck s ASN 37 Ca 0.60 0.71 0.05 0.00 -1.02 0.00 0.00 52.86 53.21 1xck s ASN 37 Cb -0.08 -2.15 -0.01 0.00 0.02 0.00 0.00 41.25 39.03 1xck s ASN 37 CO 0.40 0.21 -0.23 -0.69 0.02 0.00 0.00 177.10 176.81 1xck s VAL 38 N -1.34 2.23 -0.30 1.60 1.01 0.65 -4.93 120.40 119.32 1xck s VAL 38 Ca 0.30 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 1xck s VAL 38 Cb -0.14 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 1xck s VAL 38 CO 0.17 0.57 0.18 -0.69 0.00 0.00 0.00 175.10 175.32 1xck s VAL 39 N -0.09 5.02 -0.30 2.92 1.01 -1.26 -0.91 120.40 126.78 1xck s VAL 39 Ca -0.05 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 1xck s VAL 39 Cb -0.14 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1xck s VAL 39 CO 0.04 0.16 0.13 -0.76 0.00 0.00 0.00 175.10 174.68 1xck s LEU 40 N 1.70 3.98 0.44 3.92 1.43 0.17 -4.91 118.68 125.42 1xck s LEU 40 Ca 0.06 -0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 52.44 1xck s LEU 40 Cb -0.16 -1.98 -0.08 0.00 0.03 0.00 0.00 46.19 44.00 1xck s LEU 40 CO 0.09 -0.17 1.10 -0.62 0.23 0.00 0.00 176.35 176.98 1xck s ASP 41 N 1.60 6.42 -0.07 2.29 2.15 -1.26 0.22 116.67 128.02 1xck s ASP 41 Ca 0.05 2.14 0.02 0.00 0.43 0.00 0.00 52.55 55.19 1xck s ASP 41 Cb -0.17 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 1xck s ASP 41 CO 0.06 -0.74 -0.11 -0.54 -0.17 0.00 0.00 175.17 173.67 1xck s LYS 42 N -2.70 1.63 0.33 4.34 1.02 -1.26 -4.88 119.74 118.22 1xck s LYS 42 Ca 0.62 -0.38 0.12 0.00 0.02 0.00 0.00 55.97 56.35 1xck s LYS 42 Cb -0.24 -1.37 1.03 0.00 -0.52 0.00 0.00 37.83 36.73 1xck s LYS 42 CO 0.30 0.00 1.65 0.66 -0.92 0.00 0.00 175.35 177.04 1xck h SER 43 N 7.05 0.35 -3.52 2.83 4.64 -1.96 -3.37 113.55 119.57 1xck h SER 43 Ca -0.31 0.20 -0.67 0.00 -0.47 0.00 0.00 61.79 60.54 1xck h SER 43 Cb 1.18 0.19 -0.28 0.00 -0.31 0.00 0.00 62.40 63.19 1xck h SER 43 CO 0.47 -0.18 -0.69 -0.36 -0.87 0.00 0.00 176.83 175.20 1xck s PHE 44 N -5.71 3.06 0.00 4.77 0.08 -1.26 -5.04 117.98 113.88 1xck s PHE 44 Ca -0.10 -1.07 0.00 0.00 0.12 0.00 0.00 56.93 55.87 1xck s PHE 44 Cb 0.30 -2.16 0.00 0.00 -0.57 0.00 0.00 43.02 40.59 1xck s PHE 44 CO 0.78 -0.59 0.00 0.41 -0.10 0.00 0.00 175.22 175.72 1xck n GLY 45 N 4.80 -1.51 3.85 4.36 0.00 -1.26 -4.96 105.19 110.47 1xck n GLY 45 Ca -0.16 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.63 1xck n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xck s ALA 46 N -1.91 3.28 0.95 4.61 0.00 -1.26 -4.82 121.76 122.61 1xck s ALA 46 Ca 0.00 0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1xck s ALA 46 Cb 0.00 -2.82 0.16 0.00 0.00 0.00 0.00 23.12 20.46 1xck s ALA 46 CO 0.00 0.19 1.11 -2.14 0.00 0.00 0.00 175.76 174.91 1xck s PRO 47 N -3.29 0.80 -0.18 0.00 0.02 -1.26 -4.65 135.00 126.43 1xck s PRO 47 Ca 0.55 1.24 -0.10 0.00 0.02 0.00 0.00 61.00 62.71 1xck s PRO 47 Cb -0.10 -1.72 -0.05 0.00 0.02 0.00 0.00 34.50 32.65 1xck s PRO 47 CO 0.21 -2.68 0.15 0.99 -0.33 0.00 0.00 177.00 175.34 1xck s THR 48 N -2.68 5.41 -0.20 0.99 2.01 0.13 -4.92 115.64 116.39 1xck s THR 48 Ca 0.66 0.24 -0.06 0.00 0.31 0.00 0.00 61.69 62.84 1xck s THR 48 Cb -0.22 -3.48 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1xck s THR 48 CO 0.59 0.46 0.01 -0.63 -0.69 0.00 0.00 174.62 174.37 1xck s ILE 49 N 0.14 4.14 0.10 1.82 1.01 -1.26 0.44 121.20 127.60 1xck s ILE 49 Ca 0.10 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.45 1xck s ILE 49 Cb -0.11 -2.87 -0.02 0.00 0.01 0.00 0.00 42.46 39.46 1xck s ILE 49 CO -0.00 0.43 0.12 0.28 0.00 0.00 0.00 174.94 175.77 1xck s THR 50 N 0.86 0.14 0.00 2.92 -1.32 -0.09 -4.95 115.64 113.20 1xck s THR 50 Ca 0.01 -1.55 0.00 0.00 -1.21 0.00 0.00 61.69 58.95 1xck s THR 50 Cb -0.14 -1.65 0.00 0.00 -1.51 0.00 0.00 72.50 69.20 1xck s THR 50 CO 0.02 -0.62 0.88 0.29 -2.21 0.00 0.00 174.62 172.97 1xck n LYS 51 N -0.06 2.17 -2.95 7.08 5.02 -1.26 -0.25 118.16 127.91 1xck n LYS 51 Ca -0.11 -1.26 -0.43 0.00 -2.02 0.00 0.00 58.31 54.49 1xck n LYS 51 Cb 0.62 -0.95 -0.05 0.00 -0.02 0.00 0.00 35.03 34.64 1xck n LYS 51 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1xck s ASP 52 N -0.77 6.33 0.56 4.39 2.15 -1.26 -4.81 116.67 123.27 1xck s ASP 52 Ca 0.00 -0.42 0.26 0.00 0.43 0.00 0.00 52.55 52.82 1xck s ASP 52 Cb 0.00 -2.39 1.50 0.00 -0.30 0.00 0.00 42.92 41.74 1xck s ASP 52 CO 0.00 -1.06 2.04 1.23 -0.17 0.00 0.00 175.17 177.20 1xck h GLY 53 N 10.44 0.00 1.33 2.66 0.00 -1.87 -1.05 103.07 114.58 1xck h GLY 53 Ca -0.26 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 1xck h GLY 53 CO 1.02 0.00 -0.68 -2.08 0.00 0.00 0.00 176.54 174.81 1xck h VAL 54 N 0.00 1.31 -0.24 4.60 2.07 -1.96 -1.00 116.25 121.04 1xck h VAL 54 Ca 0.16 -1.93 -0.02 0.00 0.82 0.00 0.00 66.70 65.73 1xck h VAL 54 Cb 0.74 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1xck h VAL 54 CO -0.00 0.61 0.06 0.28 0.02 0.00 0.00 177.57 178.54 1xck h SER 55 N 0.48 0.35 0.54 0.57 0.02 -1.63 -2.27 113.55 111.61 1xck h SER 55 Ca -0.02 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 1xck h SER 55 Cb 1.27 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1xck h SER 55 CO 0.13 0.48 -0.27 0.58 -1.14 0.00 0.00 176.83 176.62 1xck h VAL 56 N 0.21 0.45 -1.01 2.27 2.07 -1.36 -2.85 116.25 116.02 1xck h VAL 56 Ca 0.07 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.79 1xck h VAL 56 Cb 0.26 0.45 -0.11 0.00 -1.52 0.00 0.00 31.29 30.37 1xck h VAL 56 CO -0.00 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.20 1xck h ALA 57 N -0.27 1.69 -0.92 1.67 0.00 -1.15 -0.04 119.26 120.23 1xck h ALA 57 Ca -0.07 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 57 Cb 0.57 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1xck h ALA 57 CO 0.11 -0.07 0.59 -0.09 0.00 0.00 0.00 179.25 179.79 1xck h ARG 58 N 0.75 0.82 0.00 0.00 2.43 -1.17 -2.08 114.38 115.13 1xck h ARG 58 Ca 0.59 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1xck h ARG 58 Cb 0.94 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1xck h ARG 58 CO -0.39 0.54 0.00 0.93 -1.51 0.00 0.00 179.97 179.54 1xck h GLU 59 N 0.84 0.00 -6.19 0.20 4.39 -0.94 -3.46 114.58 109.42 1xck h GLU 59 Ca 0.44 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.58 1xck h GLU 59 Cb 0.54 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.15 1xck h GLU 59 CO -0.21 0.00 0.85 0.42 -1.16 0.00 0.00 179.01 178.91 1xck s ILE 60 N -3.15 4.29 -0.21 3.13 -1.09 -0.78 -4.98 121.20 118.40 1xck s ILE 60 Ca 0.09 1.57 -0.09 0.00 -2.23 0.00 0.00 60.65 59.99 1xck s ILE 60 Cb 0.11 -4.01 0.08 0.00 -1.58 0.00 0.00 42.46 37.05 1xck s ILE 60 CO 0.59 -0.10 0.47 -0.70 -1.23 0.00 0.00 174.94 173.97 1xck s GLU 61 N 3.14 0.42 0.07 2.79 2.12 -1.26 -4.91 118.70 121.07 1xck s GLU 61 Ca 0.55 1.01 -0.00 0.00 0.36 0.00 0.00 54.97 56.88 1xck s GLU 61 Cb -0.22 0.23 -0.04 0.00 0.26 0.00 0.00 34.13 34.35 1xck s GLU 61 CO 0.16 -0.20 0.22 -0.51 -0.54 0.00 0.00 175.26 174.40 1xck s LEU 62 N 2.06 4.35 0.09 2.70 1.43 -1.26 -5.03 118.68 123.02 1xck s LEU 62 Ca -0.06 0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 53.17 1xck s LEU 62 Cb -0.10 -2.99 -0.08 0.00 0.03 0.00 0.00 46.19 43.06 1xck s LEU 62 CO -0.14 0.16 1.47 -0.08 0.23 0.00 0.00 176.35 177.99 1xck h GLU 63 N 3.07 0.56 -6.26 1.70 4.81 -2.01 -3.42 114.58 113.03 1xck h GLU 63 Ca -0.45 -0.23 -0.55 0.00 -0.13 0.00 0.00 59.36 58.00 1xck h GLU 63 Cb 1.16 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 1xck h GLU 63 CO 0.76 0.78 1.14 0.34 -0.73 0.00 0.00 179.01 181.30 1xck s ASP 64 N -6.20 6.52 0.27 1.04 -1.08 -1.26 -4.89 116.67 111.06 1xck s ASP 64 Ca -0.13 2.16 -0.00 0.00 -0.52 0.00 0.00 52.55 54.05 1xck s ASP 64 Cb 0.08 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.57 1xck s ASP 64 CO 0.78 -1.06 1.77 0.11 0.52 0.00 0.00 175.17 177.29 1xck h LYS 65 N 10.20 0.65 -0.09 4.34 1.79 -1.94 -0.06 116.57 131.47 1xck h LYS 65 Ca -0.40 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.00 1xck h LYS 65 Cb 1.18 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 31.69 1xck h LYS 65 CO 0.96 0.43 -0.07 0.74 -1.08 0.00 0.00 179.45 180.43 1xck h PHE 66 N 0.67 0.24 -0.95 -1.35 0.04 -1.94 -1.99 116.94 111.65 1xck h PHE 66 Ca 0.48 -0.07 0.03 0.00 2.80 0.00 0.00 57.97 61.21 1xck h PHE 66 Cb 0.67 -0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.72 1xck h PHE 66 CO -0.08 0.61 0.62 0.93 -0.60 0.00 0.00 178.31 179.79 1xck h GLU 67 N -0.20 1.19 -0.60 1.51 5.08 -1.60 -2.26 114.58 117.69 1xck h GLU 67 Ca 0.02 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 67 Cb 0.56 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1xck h GLU 67 CO 0.02 0.79 0.31 -0.97 -1.00 0.00 0.00 179.01 178.15 1xck h ASN 68 N 1.22 0.78 -0.84 1.42 -1.24 -0.92 -1.62 115.58 114.38 1xck h ASN 68 Ca 0.37 -0.12 0.04 0.00 0.71 0.00 0.00 56.30 57.31 1xck h ASN 68 Cb -0.04 -0.20 -0.05 0.00 0.73 0.00 0.00 38.32 38.76 1xck h ASN 68 CO -0.10 0.67 0.55 0.24 -1.29 0.00 0.00 177.43 177.50 1xck h MET 69 N 0.82 0.98 0.11 6.67 2.86 -0.79 0.27 114.93 125.85 1xck h MET 69 Ca 0.21 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1xck h MET 69 Cb 0.09 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.53 1xck h MET 69 CO -0.03 0.65 -0.05 0.78 1.06 0.00 0.00 176.91 179.32 1xck h GLY 70 N 1.01 -0.15 0.98 8.32 0.00 -0.95 -0.84 103.07 111.43 1xck h GLY 70 Ca 0.34 0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.73 1xck h GLY 70 CO -0.11 -0.06 0.18 0.00 0.00 0.00 0.00 176.54 176.55 1xck h ALA 71 N 0.60 0.37 -0.46 3.60 0.00 -0.65 -2.76 119.26 119.97 1xck h ALA 71 Ca -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 71 Cb 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xck h ALA 71 CO 0.02 -0.12 0.26 1.96 0.00 0.00 0.00 179.25 181.37 1xck h GLN 72 N 0.37 0.62 0.24 0.00 1.08 -0.42 -0.38 115.11 116.63 1xck h GLN 72 Ca 0.11 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.24 1xck h GLN 72 Cb 0.02 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.32 1xck h GLN 72 CO -0.02 0.45 -0.12 0.52 -0.95 0.00 0.00 178.83 178.71 1xck h MET 73 N 0.63 -0.31 0.00 1.46 2.86 -0.85 -0.60 114.93 118.11 1xck h MET 73 Ca 0.16 0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.68 1xck h MET 73 Cb -0.00 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1xck h MET 73 CO -0.03 -0.10 -0.67 -0.39 1.06 0.00 0.00 176.91 176.78 1xck h VAL 74 N -0.47 1.44 -0.84 -2.22 -1.51 -1.46 -2.91 116.25 108.27 1xck h VAL 74 Ca -0.03 -2.34 0.05 0.00 -1.23 0.00 0.00 66.70 63.14 1xck h VAL 74 Cb 0.36 2.28 -0.05 0.00 -2.13 0.00 0.00 31.29 31.74 1xck h VAL 74 CO 0.05 0.66 0.53 0.50 -1.23 0.00 0.00 177.57 178.09 1xck h LYS 75 N 0.00 0.98 0.66 5.19 3.64 -0.91 0.48 116.57 126.62 1xck h LYS 75 Ca -0.01 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 1xck h LYS 75 Cb 1.22 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.83 1xck h LYS 75 CO 0.09 0.65 -0.32 1.49 -2.27 0.00 0.00 179.45 179.09 1xck h GLU 76 N 1.01 -0.86 0.00 1.90 4.81 -0.92 -2.75 114.58 117.78 1xck h GLU 76 Ca 0.35 0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.59 1xck h GLU 76 Cb 0.08 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1xck h GLU 76 CO -0.14 -0.56 -0.23 -0.39 -0.73 0.00 0.00 179.01 176.96 1xck h VAL 77 N -1.20 1.02 -0.55 0.32 -1.51 -1.48 -2.29 116.25 110.55 1xck h VAL 77 Ca -0.09 -0.83 -0.07 0.00 -1.23 0.00 0.00 66.70 64.48 1xck h VAL 77 Cb 0.70 1.47 -0.02 0.00 -2.13 0.00 0.00 31.29 31.31 1xck h VAL 77 CO 0.15 0.23 0.06 0.00 -1.23 0.00 0.00 177.57 176.78 1xck h ALA 78 N 1.77 1.07 -0.32 5.19 0.00 -0.92 -2.25 119.26 123.81 1xck h ALA 78 Ca -0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1xck h ALA 78 Cb 0.45 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1xck h ALA 78 CO 0.03 0.60 -0.03 0.66 0.00 0.00 0.00 179.25 180.51 1xck h SER 79 N 0.84 0.47 -0.30 0.00 4.64 -1.10 -1.67 113.55 116.43 1xck h SER 79 Ca 0.17 -0.09 0.09 0.00 -0.47 0.00 0.00 61.79 61.48 1xck h SER 79 Cb 0.41 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1xck h SER 79 CO 0.01 0.56 0.24 0.11 -0.87 0.00 0.00 176.83 176.89 1xck h LYS 80 N 0.48 0.00 -0.18 4.77 1.57 -1.27 0.06 116.57 121.99 1xck h LYS 80 Ca 0.10 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1xck h LYS 80 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1xck h LYS 80 CO 0.01 0.00 -0.02 0.00 -0.57 0.00 0.00 179.45 178.88 1xck h ALA 81 N 1.79 0.25 -0.81 3.86 0.00 -1.29 -1.56 119.26 121.50 1xck h ALA 81 Ca 0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1xck h ALA 81 Cb 0.63 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1xck h ALA 81 CO -0.00 -0.02 0.41 -0.97 0.00 0.00 0.00 179.25 178.67 1xck h ASN 82 N 0.07 1.05 -0.87 0.00 -1.24 -1.08 -1.21 115.58 112.30 1xck h ASN 82 Ca 0.05 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 56.93 1xck h ASN 82 Cb 0.42 -0.27 -0.04 0.00 0.73 0.00 0.00 38.32 39.16 1xck h ASN 82 CO 0.01 0.88 0.51 0.44 -1.29 0.00 0.00 177.43 177.98 1xck h ASP 83 N 1.15 1.05 0.27 1.15 3.32 -1.05 0.79 116.42 123.10 1xck h ASP 83 Ca 0.28 -0.08 -0.24 0.00 0.02 0.00 0.00 57.03 57.02 1xck h ASP 83 Cb 0.09 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.38 1xck h ASP 83 CO -0.04 0.82 -0.99 0.00 -1.72 0.00 0.00 179.24 177.32 1xck h ALA 84 N 1.27 0.29 0.00 3.45 0.00 -0.80 -3.39 119.26 120.09 1xck h ALA 84 Ca 0.31 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1xck h ALA 84 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xck h ALA 84 CO -0.06 0.79 0.00 0.00 0.00 0.00 0.00 179.25 179.98 1xck n ALA 85 N -2.57 1.87 -0.98 0.00 0.00 -0.50 -5.00 120.51 113.33 1xck n ALA 85 Ca -0.08 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.88 1xck n ALA 85 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 1xck n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 86 N -0.08 0.44 3.63 0.00 0.00 0.27 -4.62 105.19 104.84 1xck n GLY 86 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1xck n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xck s ASP 87 N -2.11 -0.16 0.00 1.61 2.15 -1.24 -4.97 116.67 111.95 1xck s ASP 87 Ca 0.00 -0.15 0.00 0.00 0.43 0.00 0.00 52.55 52.83 1xck s ASP 87 Cb 0.00 0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.90 1xck s ASP 87 CO 0.00 -0.49 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 1xck n GLY 88 N -0.34 0.82 0.19 2.66 0.00 -1.26 -4.00 105.19 103.26 1xck n GLY 88 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1xck n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xck h THR 89 N 0.00 1.27 -0.32 2.61 2.02 -1.89 -0.01 112.91 116.58 1xck h THR 89 Ca 0.00 -1.02 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 1xck h THR 89 Cb 0.00 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1xck h THR 89 CO 0.00 0.33 0.03 0.74 0.37 0.00 0.00 175.52 176.99 1xck h THR 90 N 0.41 1.25 -0.38 3.16 2.02 -1.90 -1.83 112.91 115.63 1xck h THR 90 Ca 0.09 -0.88 0.05 0.00 0.77 0.00 0.00 66.41 66.43 1xck h THR 90 Cb 0.49 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 68.06 1xck h THR 90 CO 0.02 0.29 0.12 0.74 0.37 0.00 0.00 175.52 177.06 1xck h THR 91 N 0.36 0.87 -0.98 3.16 2.02 -1.96 -0.64 112.91 115.74 1xck h THR 91 Ca 0.09 -0.09 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1xck h THR 91 Cb 0.39 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 1xck h THR 91 CO 0.01 0.05 0.64 0.00 0.37 0.00 0.00 175.52 176.59 1xck h ALA 92 N 1.25 1.42 0.12 6.16 0.00 -0.82 -0.41 119.26 126.98 1xck h ALA 92 Ca 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 92 Cb 0.16 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1xck h ALA 92 CO -0.19 0.44 -0.06 1.15 0.00 0.00 0.00 179.25 180.59 1xck h THR 93 N 1.16 1.03 -0.34 0.00 2.02 -0.37 0.16 112.91 116.57 1xck h THR 93 Ca 0.42 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 1xck h THR 93 Cb 0.15 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 1xck h THR 93 CO -0.16 0.15 0.10 -0.37 0.37 0.00 0.00 175.52 175.60 1xck h VAL 94 N -0.44 1.15 -0.19 3.16 -1.51 -0.85 -0.27 116.25 117.29 1xck h VAL 94 Ca -0.02 -0.52 -0.02 0.00 -1.23 0.00 0.00 66.70 64.92 1xck h VAL 94 Cb 0.36 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.31 1xck h VAL 94 CO 0.03 0.19 0.05 -0.07 -1.23 0.00 0.00 177.57 176.54 1xck h LEU 95 N 0.48 0.28 -0.76 4.19 3.38 -0.85 -1.48 115.31 120.56 1xck h LEU 95 Ca 0.12 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1xck h LEU 95 Cb 0.16 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1xck h LEU 95 CO -0.01 0.43 0.48 0.00 0.09 0.00 0.00 178.44 179.44 1xck h ALA 96 N 0.86 0.99 -0.45 1.53 0.00 0.04 -1.16 119.26 121.06 1xck h ALA 96 Ca 0.06 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1xck h ALA 96 Cb 0.26 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1xck h ALA 96 CO 0.00 0.29 0.26 0.37 0.00 0.00 0.00 179.25 180.17 1xck h GLN 97 N 0.94 0.50 0.46 0.00 4.15 -0.77 0.16 115.11 120.55 1xck h GLN 97 Ca 0.30 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.67 1xck h GLN 97 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.58 1xck h GLN 97 CO -0.11 0.33 -0.24 0.00 -1.93 0.00 0.00 178.83 176.89 1xck h ALA 98 N 1.21 -0.64 -0.10 3.38 0.00 -0.72 -0.57 119.26 121.82 1xck h ALA 98 Ca 0.18 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1xck h ALA 98 Cb 0.03 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1xck h ALA 98 CO -0.09 -0.86 0.03 0.82 0.00 0.00 0.00 179.25 179.14 1xck h ILE 99 N -0.64 0.98 -0.59 0.00 2.04 -1.04 -2.52 117.51 115.74 1xck h ILE 99 Ca -0.06 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.82 1xck h ILE 99 Cb 0.50 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 1xck h ILE 99 CO 0.09 0.01 0.32 0.40 0.00 0.00 0.00 178.15 178.97 1xck h ILE 100 N 0.08 0.97 0.64 -0.67 2.04 -0.60 0.88 117.51 120.85 1xck h ILE 100 Ca 0.04 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1xck h ILE 100 Cb 0.02 0.32 0.01 0.00 -0.74 0.00 0.00 36.82 36.42 1xck h ILE 100 CO -0.04 0.11 -0.31 0.74 0.00 0.00 0.00 178.15 178.65 1xck h THR 101 N 0.60 0.37 -0.44 -0.27 2.02 -0.92 -0.79 112.91 113.48 1xck h THR 101 Ca 0.26 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.33 1xck h THR 101 Cb 0.15 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1xck h THR 101 CO -0.16 0.00 -0.06 -0.33 0.37 0.00 0.00 175.52 175.34 1xck h GLU 102 N -0.88 0.76 -0.41 6.66 4.39 -1.40 -2.25 114.58 121.45 1xck h GLU 102 Ca -0.09 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.38 1xck h GLU 102 Cb 0.66 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 1xck h GLU 102 CO 0.14 0.81 0.23 0.78 -1.16 0.00 0.00 179.01 179.82 1xck h GLY 103 N 0.97 0.61 1.81 -3.84 0.00 -0.74 -1.77 103.07 100.12 1xck h GLY 103 Ca 0.13 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 1xck h GLY 103 CO 0.03 0.26 -0.25 1.41 0.00 0.00 0.00 176.54 177.99 1xck h LEU 104 N 0.53 0.22 -0.18 3.11 3.38 -1.01 -0.24 115.31 121.12 1xck h LEU 104 Ca 0.14 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1xck h LEU 104 Cb 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1xck h LEU 104 CO -0.02 0.47 0.09 0.11 0.09 0.00 0.00 178.44 179.18 1xck h LYS 105 N 0.20 0.18 -0.49 1.13 1.57 -0.94 -0.21 116.57 118.01 1xck h LYS 105 Ca 0.03 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1xck h LYS 105 Cb 0.55 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1xck h LYS 105 CO 0.04 0.12 0.29 0.00 -0.57 0.00 0.00 179.45 179.33 1xck h ALA 106 N 1.09 0.62 -0.92 3.86 0.00 -0.62 -0.37 119.26 122.93 1xck h ALA 106 Ca 0.07 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 106 Cb 0.02 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 1xck h ALA 106 CO -0.05 0.11 0.60 0.28 0.00 0.00 0.00 179.25 180.19 1xck h VAL 107 N 0.65 1.17 -0.08 0.00 2.07 -0.66 -0.99 116.25 118.41 1xck h VAL 107 Ca 0.18 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 1xck h VAL 107 Cb -0.00 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.65 1xck h VAL 107 CO -0.03 0.21 -0.36 0.00 0.02 0.00 0.00 177.57 177.41 1xck h ALA 108 N 1.37 1.23 0.00 1.67 0.00 -0.50 -0.67 119.26 122.36 1xck h ALA 108 Ca 0.36 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xck h ALA 108 Cb -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1xck h ALA 108 CO -0.11 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.67 1xck n ALA 109 N -2.47 2.29 -0.40 0.00 0.00 -0.20 -4.84 120.51 114.89 1xck n ALA 109 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1xck n ALA 109 Cb 0.43 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1xck n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 110 N 0.34 0.79 3.83 0.00 0.00 -0.26 -5.07 105.19 104.83 1xck n GLY 110 Ca 0.16 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1xck n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xck s MET 111 N -0.62 4.05 -0.12 1.61 1.00 -0.64 -4.98 119.30 119.60 1xck s MET 111 Ca 0.00 1.03 -0.29 0.00 0.00 0.00 0.00 55.69 56.42 1xck s MET 111 Cb 0.00 -2.15 -0.04 0.00 0.00 0.00 0.00 34.83 32.64 1xck s MET 111 CO 0.00 -0.19 1.51 1.21 0.00 0.00 0.00 175.02 177.55 1xck s ASN 112 N -2.71 6.72 0.18 3.03 3.84 -1.26 -4.43 114.94 120.31 1xck s ASN 112 Ca 0.60 1.96 -0.14 0.00 0.21 0.00 0.00 52.86 55.49 1xck s ASN 112 Cb -0.10 -2.53 0.15 0.00 -0.55 0.00 0.00 41.25 38.22 1xck s ASN 112 CO 0.24 -0.92 1.72 -0.65 -2.79 0.00 0.00 177.10 174.70 1xck h PRO 113 N 9.24 0.20 -0.57 0.43 0.11 -1.94 -0.46 132.00 139.02 1xck h PRO 113 Ca -0.34 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 1xck h PRO 113 Cb 1.15 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1xck h PRO 113 CO 0.97 0.13 0.30 0.52 -0.21 0.00 0.00 178.00 179.71 1xck h MET 114 N 0.21 0.79 -0.12 1.05 2.86 -1.91 -0.86 114.93 116.94 1xck h MET 114 Ca 0.22 -0.08 -0.21 0.00 -2.06 0.00 0.00 59.70 57.57 1xck h MET 114 Cb 0.29 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 31.80 1xck h MET 114 CO -0.30 0.59 -0.77 -0.44 1.06 0.00 0.00 176.91 177.04 1xck h ASP 115 N 0.79 0.79 -0.95 1.22 3.32 -1.74 -1.98 116.42 117.87 1xck h ASP 115 Ca 0.20 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 1xck h ASP 115 Cb 0.04 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.31 1xck h ASP 115 CO -0.03 1.30 0.57 -0.07 -1.72 0.00 0.00 179.24 179.29 1xck h LEU 116 N 0.45 1.14 -0.20 1.55 3.38 -0.64 -0.39 115.31 120.60 1xck h LEU 116 Ca -0.05 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1xck h LEU 116 Cb 1.38 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1xck h LEU 116 CO 0.15 0.87 0.00 0.50 0.09 0.00 0.00 178.44 180.05 1xck h LYS 117 N 1.31 0.36 -0.88 1.13 3.64 -1.09 -1.91 116.57 119.13 1xck h LYS 117 Ca 0.34 -0.11 0.03 0.00 -1.27 0.00 0.00 60.65 59.64 1xck h LYS 117 Cb -0.06 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 1xck h LYS 117 CO -0.06 0.55 0.58 -0.09 -2.27 0.00 0.00 179.45 178.16 1xck h ARG 118 N 0.12 1.08 -0.50 1.90 2.43 -0.83 0.50 114.38 119.08 1xck h ARG 118 Ca 0.06 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 1xck h ARG 118 Cb 0.39 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1xck h ARG 118 CO 0.01 0.72 -0.13 0.78 -1.51 0.00 0.00 179.97 179.84 1xck h GLY 119 N 1.12 1.06 0.92 2.80 0.00 -0.98 -0.42 103.07 107.56 1xck h GLY 119 Ca 0.34 -0.88 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1xck h GLY 119 CO -0.10 0.80 0.12 -2.22 0.00 0.00 0.00 176.54 175.15 1xck h ILE 120 N 0.84 1.18 -0.65 2.60 2.04 -0.64 -1.50 117.51 121.38 1xck h ILE 120 Ca 0.13 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1xck h ILE 120 Cb 0.70 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1xck h ILE 120 CO 0.05 0.19 0.40 0.44 0.00 0.00 0.00 178.15 179.23 1xck h ASP 121 N 0.34 0.77 -0.22 1.72 3.32 -0.78 -0.53 116.42 121.04 1xck h ASP 121 Ca 0.10 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xck h ASP 121 Cb 0.18 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1xck h ASP 121 CO -0.01 0.60 0.14 0.50 -1.72 0.00 0.00 179.24 178.75 1xck h LYS 122 N 0.88 0.29 -0.36 3.56 3.64 -0.86 -0.23 116.57 123.48 1xck h LYS 122 Ca 0.23 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1xck h LYS 122 Cb -0.04 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 1xck h LYS 122 CO -0.04 0.19 0.08 0.00 -2.27 0.00 0.00 179.45 177.41 1xck h ALA 123 N 1.09 0.39 -0.30 5.00 0.00 -0.87 -0.77 119.26 123.79 1xck h ALA 123 Ca 0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xck h ALA 123 Cb -0.03 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xck h ALA 123 CO -0.02 -0.32 0.16 0.28 0.00 0.00 0.00 179.25 179.35 1xck h VAL 124 N 0.21 1.13 -0.34 0.00 2.07 -0.81 0.35 116.25 118.87 1xck h VAL 124 Ca 0.17 -0.35 0.05 0.00 0.82 0.00 0.00 66.70 67.39 1xck h VAL 124 Cb 0.18 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1xck h VAL 124 CO -0.21 0.13 0.05 0.74 0.02 0.00 0.00 177.57 178.31 1xck h THR 125 N 0.37 0.82 -0.74 2.57 2.02 -0.67 0.14 112.91 117.41 1xck h THR 125 Ca 0.11 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 1xck h THR 125 Cb 0.07 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1xck h THR 125 CO -0.02 0.03 0.33 0.00 0.37 0.00 0.00 175.52 176.23 1xck h ALA 126 N 1.26 1.18 -0.70 6.16 0.00 -0.87 -2.57 119.26 123.72 1xck h ALA 126 Ca 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 126 Cb 0.19 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1xck h ALA 126 CO -0.22 0.61 0.24 0.00 0.00 0.00 0.00 179.25 179.88 1xck h ALA 127 N 1.29 0.91 -0.55 0.00 0.00 0.91 -1.85 119.26 119.98 1xck h ALA 127 Ca 0.25 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1xck h ALA 127 Cb 0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1xck h ALA 127 CO -0.03 0.57 0.18 0.28 0.00 0.00 0.00 179.25 180.25 1xck h VAL 128 N 1.01 1.21 -0.13 0.00 2.07 -0.39 0.41 116.25 120.44 1xck h VAL 128 Ca 0.23 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 1xck h VAL 128 Cb 0.27 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1xck h VAL 128 CO -0.01 0.28 -0.10 -0.33 0.02 0.00 0.00 177.57 177.43 1xck h GLU 129 N 0.80 0.29 -0.17 1.57 4.39 -1.23 -2.11 114.58 118.12 1xck h GLU 129 Ca 0.18 -0.14 0.05 0.00 0.34 0.00 0.00 59.36 59.79 1xck h GLU 129 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1xck h GLU 129 CO -0.01 0.67 0.16 1.49 -1.16 0.00 0.00 179.01 180.16 1xck h GLU 130 N -0.08 0.00 -0.01 2.33 4.57 -0.98 -0.37 114.58 120.05 1xck h GLU 130 Ca 0.02 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.00 1xck h GLU 130 Cb 0.60 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 1xck h GLU 130 CO 0.03 0.00 -0.88 1.25 -1.18 0.00 0.00 179.01 178.22 1xck h LEU 131 N 0.00 0.41 -0.56 1.64 5.85 -0.43 -2.11 115.31 120.11 1xck h LEU 131 Ca 0.08 -0.32 -0.15 0.00 0.84 0.00 0.00 57.88 58.33 1xck h LEU 131 Cb 0.41 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1xck h LEU 131 CO -0.00 1.11 -0.53 0.11 -0.34 0.00 0.00 178.44 178.79 1xck h LYS 132 N 0.19 0.52 -0.34 1.25 1.57 -0.43 -2.19 116.57 117.12 1xck h LYS 132 Ca -0.06 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.33 1xck h LYS 132 Cb 1.50 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.84 1xck h LYS 132 CO 0.15 0.92 -0.07 0.00 -0.57 0.00 0.00 179.45 179.87 1xck h ALA 133 N 1.02 0.47 0.00 3.86 0.00 -1.36 -2.68 119.26 120.56 1xck h ALA 133 Ca 0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1xck h ALA 133 Cb 1.06 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1xck h ALA 133 CO 0.10 0.30 -0.21 1.25 0.00 0.00 0.00 179.25 180.69 1xck h LEU 134 N 0.44 0.00 -9.80 0.00 7.12 -1.32 -3.45 115.31 108.29 1xck h LEU 134 Ca 0.09 0.00 -0.56 0.00 0.13 0.00 0.00 57.88 57.53 1xck h LEU 134 Cb 0.57 0.00 0.12 0.00 -0.53 0.00 0.00 40.66 40.82 1xck h LEU 134 CO 0.03 0.21 0.47 -0.24 -0.13 0.00 0.00 178.44 178.78 1xck n SER 135 N -4.20 2.50 -4.34 1.25 2.88 -0.83 -4.89 113.62 105.99 1xck n SER 135 Ca -0.02 1.12 -0.33 0.00 -1.33 0.00 0.00 58.87 58.31 1xck n SER 135 Cb 0.27 -1.49 -0.15 0.00 -0.75 0.00 0.00 64.21 62.09 1xck n SER 135 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1xck s VAL 136 N -1.18 2.82 0.73 2.46 1.01 -0.31 -4.94 120.40 121.00 1xck s VAL 136 Ca 0.60 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.69 1xck s VAL 136 Cb -0.52 -2.16 0.04 0.00 0.00 0.00 0.00 36.38 33.74 1xck s VAL 136 CO 0.59 0.54 1.18 -2.84 0.00 0.00 0.00 175.10 174.56 1xck s PRO 137 N 0.29 2.18 -0.39 2.72 0.02 -1.26 -1.12 135.00 137.43 1xck s PRO 137 Ca -0.12 1.66 0.02 0.00 0.02 0.00 0.00 61.00 62.59 1xck s PRO 137 Cb -0.16 -1.85 0.16 0.00 0.02 0.00 0.00 34.50 32.67 1xck s PRO 137 CO 0.06 -1.78 0.29 0.00 -0.33 0.00 0.00 177.00 175.23 1xck n SER 139 N 3.36 1.14 -4.77 0.00 7.64 -1.26 -4.20 113.62 115.53 1xck n SER 139 Ca 0.21 0.16 -0.40 0.00 1.01 0.00 0.00 58.87 59.85 1xck n SER 139 Cb 0.42 -0.38 0.01 0.00 -1.01 0.00 0.00 64.21 63.25 1xck n SER 139 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1xck s ASP 140 N -5.90 5.98 0.09 6.43 -4.77 -1.26 -4.75 116.67 112.48 1xck s ASP 140 Ca -0.07 2.93 0.06 0.00 -3.30 0.00 0.00 52.55 52.17 1xck s ASP 140 Cb 0.01 -2.66 0.32 0.00 -1.09 0.00 0.00 42.92 39.50 1xck s ASP 140 CO 0.10 -1.11 1.16 -1.54 0.70 0.00 0.00 175.17 174.48 1xck n SER 141 N -0.06 0.15 -0.01 2.11 3.41 -1.26 -0.70 113.62 117.26 1xck n SER 141 Ca 0.04 0.56 -0.14 0.00 -0.26 0.00 0.00 58.87 59.07 1xck n SER 141 Cb 0.41 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 1xck n SER 141 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1xck h LYS 142 N 0.00 0.68 -0.08 4.33 3.64 -2.00 -2.13 116.57 121.01 1xck h LYS 142 Ca 0.00 -0.51 -0.13 0.00 -1.27 0.00 0.00 60.65 58.74 1xck h LYS 142 Cb 0.04 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1xck h LYS 142 CO 0.00 1.13 -0.45 0.00 -2.27 0.00 0.00 179.45 177.86 1xck h ALA 143 N 0.74 0.17 -0.76 5.00 0.00 -1.26 -2.64 119.26 120.50 1xck h ALA 143 Ca -0.03 -0.49 0.15 0.00 0.00 0.00 0.00 54.91 54.54 1xck h ALA 143 Cb 1.29 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 1xck h ALA 143 CO 0.14 0.32 0.51 0.82 0.00 0.00 0.00 179.25 181.03 1xck h ILE 144 N 0.02 0.80 -0.14 0.00 2.04 -1.37 -0.23 117.51 118.63 1xck h ILE 144 Ca -0.03 -0.15 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 1xck h ILE 144 Cb 1.10 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1xck h ILE 144 CO 0.09 0.08 -0.39 0.00 0.00 0.00 0.00 178.15 177.93 1xck h ALA 145 N 1.64 0.23 -0.42 1.87 0.00 -1.31 -2.42 119.26 118.85 1xck h ALA 145 Ca 0.37 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 145 Cb 0.82 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1xck h ALA 145 CO -0.12 0.33 0.23 1.96 0.00 0.00 0.00 179.25 181.64 1xck h GLN 146 N 0.12 0.59 0.61 0.00 4.20 -0.79 0.39 115.11 120.24 1xck h GLN 146 Ca -0.01 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 1xck h GLN 146 Cb 1.01 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.68 1xck h GLN 146 CO 0.08 0.47 -0.29 0.28 -0.67 0.00 0.00 178.83 178.70 1xck h VAL 147 N 0.55 0.40 -0.87 -0.54 2.07 -1.17 0.01 116.25 116.69 1xck h VAL 147 Ca 0.15 -0.02 0.16 0.00 0.82 0.00 0.00 66.70 67.81 1xck h VAL 147 Cb 0.06 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 30.16 1xck h VAL 147 CO -0.02 0.00 0.57 1.23 0.02 0.00 0.00 177.57 179.37 1xck h GLY 148 N -0.83 1.05 1.20 2.17 0.00 -1.30 0.69 103.07 106.06 1xck h GLY 148 Ca -0.08 -0.25 -0.15 0.00 0.00 0.00 0.00 47.33 46.84 1xck h GLY 148 CO 0.14 0.05 -0.37 -0.84 0.00 0.00 0.00 176.54 175.53 1xck h THR 149 N 0.57 1.28 -0.43 4.70 2.02 -0.45 0.46 112.91 121.06 1xck h THR 149 Ca 0.44 -1.54 -0.15 0.00 0.77 0.00 0.00 66.41 65.94 1xck h THR 149 Cb 0.86 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1xck h THR 149 CO -0.19 0.51 -0.31 0.40 0.37 0.00 0.00 175.52 176.30 1xck h ILE 150 N 0.72 1.27 0.00 3.11 2.04 0.71 0.43 117.51 125.79 1xck h ILE 150 Ca 0.06 -1.48 -0.09 0.00 1.00 0.00 0.00 64.86 64.35 1xck h ILE 150 Cb 0.94 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1xck h ILE 150 CO 0.09 0.50 -0.43 0.28 0.00 0.00 0.00 178.15 178.59 1xck h SER 151 N 0.81 0.00 -0.15 1.72 0.02 -0.84 -2.52 113.55 112.59 1xck h SER 151 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1xck h SER 151 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1xck h SER 151 CO 0.08 0.43 0.00 0.00 -1.14 0.00 0.00 176.83 176.21 1xck n ALA 152 N -2.37 2.52 -2.88 3.77 0.00 0.14 -4.47 120.51 117.22 1xck n ALA 152 Ca -0.01 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 1xck n ALA 152 Cb 0.50 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.99 1xck n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xck n ASN 153 N -0.02 -3.48 -0.34 0.00 5.15 -0.95 -3.53 115.26 112.09 1xck n ASN 153 Ca 0.05 -0.22 -0.04 0.00 -0.60 0.00 0.00 54.58 53.77 1xck n ASN 153 Cb 0.18 -2.32 -0.02 0.00 -0.53 0.00 0.00 39.78 37.09 1xck n ASN 153 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1xck n SER 154 N -0.56 -3.42 -4.41 1.20 7.64 0.15 -5.00 113.62 109.22 1xck n SER 154 Ca -0.02 0.10 -0.44 0.00 1.01 0.00 0.00 58.87 59.52 1xck n SER 154 Cb 0.53 -1.40 -0.04 0.00 -1.01 0.00 0.00 64.21 62.28 1xck n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xck s ASP 155 N -2.94 6.18 0.53 6.43 -1.08 -1.11 -4.90 116.67 119.78 1xck s ASP 155 Ca 0.00 -1.22 0.21 0.00 -0.52 0.00 0.00 52.55 51.02 1xck s ASP 155 Cb 0.00 -2.35 1.36 0.00 -1.46 0.00 0.00 42.92 40.47 1xck s ASP 155 CO 0.00 -1.24 2.08 -0.33 0.52 0.00 0.00 175.17 176.20 1xck h GLU 156 N 9.33 0.00 -0.55 4.34 5.08 -1.94 -2.11 114.58 128.74 1xck h GLU 156 Ca -0.29 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1xck h GLU 156 Cb 1.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1xck h GLU 156 CO 1.13 0.00 0.34 1.15 -1.00 0.00 0.00 179.01 180.63 1xck h THR 157 N 0.00 1.08 -0.57 1.13 2.02 -1.97 -0.53 112.91 114.06 1xck h THR 157 Ca 0.12 -0.23 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 1xck h THR 157 Cb 0.49 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1xck h THR 157 CO -0.00 0.12 -0.05 0.58 0.37 0.00 0.00 175.52 176.54 1xck h VAL 158 N 0.67 1.27 -0.09 3.16 2.07 -1.73 -0.33 116.25 121.27 1xck h VAL 158 Ca 0.22 -1.20 0.02 0.00 0.82 0.00 0.00 66.70 66.56 1xck h VAL 158 Cb 0.00 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1xck h VAL 158 CO -0.09 0.43 -0.04 1.23 0.02 0.00 0.00 177.57 179.12 1xck h GLY 159 N 0.92 0.04 0.69 2.17 0.00 -1.25 -0.50 103.07 105.14 1xck h GLY 159 Ca 0.15 0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 1xck h GLY 159 CO 0.04 -0.06 -0.32 1.70 0.00 0.00 0.00 176.54 177.90 1xck h LYS 160 N -0.03 -0.67 -0.50 4.80 3.64 -0.95 0.14 116.57 122.99 1xck h LYS 160 Ca 0.05 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.57 1xck h LYS 160 Cb 0.11 0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 31.98 1xck h LYS 160 CO -0.11 -0.45 -0.35 -0.07 -2.27 0.00 0.00 179.45 176.20 1xck h LEU 161 N -0.70 -1.18 -0.56 5.20 3.38 -0.80 0.19 115.31 120.84 1xck h LEU 161 Ca -0.03 0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1xck h LEU 161 Cb 0.62 0.56 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 1xck h LEU 161 CO -0.04 -0.32 0.33 0.40 0.09 0.00 0.00 178.44 178.90 1xck h ILE 162 N -0.22 1.17 -0.28 1.22 2.04 -0.93 -0.16 117.51 120.35 1xck h ILE 162 Ca 0.20 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1xck h ILE 162 Cb 0.55 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1xck h ILE 162 CO -0.61 0.17 0.18 0.00 0.00 0.00 0.00 178.15 177.89 1xck h ALA 163 N 1.16 0.36 -0.62 1.87 0.00 0.15 -0.49 119.26 121.69 1xck h ALA 163 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1xck h ALA 163 Cb -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1xck h ALA 163 CO -0.04 -0.18 0.29 0.93 0.00 0.00 0.00 179.25 180.25 1xck h GLU 164 N 0.37 0.90 -0.59 0.00 5.08 -0.43 -0.98 114.58 118.93 1xck h GLU 164 Ca 0.11 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1xck h GLU 164 Cb -0.03 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1xck h GLU 164 CO -0.03 0.73 0.23 0.00 -1.00 0.00 0.00 179.01 178.94 1xck h ALA 165 N 1.12 0.77 -0.08 3.43 0.00 -0.71 -1.78 119.26 122.02 1xck h ALA 165 Ca 0.21 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1xck h ALA 165 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xck h ALA 165 CO -0.02 0.39 -0.34 0.52 0.00 0.00 0.00 179.25 179.80 1xck h MET 166 N 0.83 0.15 -0.44 0.00 2.86 -0.85 -2.15 114.93 115.33 1xck h MET 166 Ca 0.20 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.70 1xck h MET 166 Cb 0.21 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1xck h MET 166 CO -0.02 0.48 -0.04 0.22 1.06 0.00 0.00 176.91 178.61 1xck h ASP 167 N 0.13 0.71 0.24 1.22 3.58 -0.62 0.61 116.42 122.29 1xck h ASP 167 Ca 0.02 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.27 1xck h ASP 167 Cb 0.67 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1xck h ASP 167 CO 0.05 0.81 -0.11 0.11 -2.88 0.00 0.00 179.24 177.22 1xck h LYS 168 N 0.68 -0.31 -0.02 0.28 1.79 -0.70 -3.34 116.57 114.95 1xck h LYS 168 Ca 0.13 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1xck h LYS 168 Cb 0.49 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1xck h LYS 168 CO 0.02 0.02 -0.41 1.33 -1.08 0.00 0.00 179.45 179.33 1xck n VAL 169 N -5.08 0.00 0.00 0.50 0.24 -0.99 -5.09 118.33 107.91 1xck n VAL 169 Ca -0.09 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 1xck n VAL 169 Cb 0.25 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 1xck n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xck n GLY 170 N 1.41 -0.18 0.35 7.63 0.00 0.21 -3.19 105.19 111.42 1xck n GLY 170 Ca 0.10 -1.73 0.06 0.00 0.00 0.00 0.00 46.02 44.45 1xck n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xck h LYS 171 N 0.00 0.93 -0.03 1.61 1.79 -1.95 -0.67 116.57 118.24 1xck h LYS 171 Ca 0.00 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1xck h LYS 171 Cb 0.00 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.44 1xck h LYS 171 CO 0.00 0.61 0.00 0.39 -1.08 0.00 0.00 179.45 179.37 1xck n GLU 172 N -4.65 1.52 -0.94 3.15 -0.58 -1.26 -4.96 120.64 112.92 1xck n GLU 172 Ca 0.17 -0.75 -0.30 0.00 -0.42 0.00 0.00 57.16 55.86 1xck n GLU 172 Cb 0.32 -1.47 0.16 0.00 -0.57 0.00 0.00 31.44 29.89 1xck n GLU 172 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1xck s GLY 173 N -1.94 1.63 -0.26 0.62 0.00 -0.26 -5.00 107.32 102.11 1xck s GLY 173 Ca 0.39 0.14 -0.14 0.00 0.00 0.00 0.00 44.72 45.11 1xck s GLY 173 CO 0.33 0.64 0.34 0.14 0.00 0.00 0.00 173.10 174.55 1xck s VAL 174 N -2.76 5.20 -0.09 1.40 1.01 -1.26 -4.96 120.40 118.95 1xck s VAL 174 Ca 0.65 0.53 0.03 0.00 0.00 0.00 0.00 61.98 63.19 1xck s VAL 174 Cb -0.21 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1xck s VAL 174 CO 0.59 0.20 -0.19 -0.63 0.00 0.00 0.00 175.10 175.07 1xck s ILE 175 N 1.84 2.60 0.25 2.22 1.01 -1.26 -0.75 121.20 127.12 1xck s ILE 175 Ca 0.14 -0.85 0.12 0.00 0.00 0.00 0.00 60.65 60.06 1xck s ILE 175 Cb -0.15 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 1xck s ILE 175 CO 0.09 0.56 -0.21 -0.89 0.00 0.00 0.00 174.94 174.49 1xck s THR 176 N -0.03 2.42 -0.05 2.92 2.01 0.07 -4.97 115.64 118.02 1xck s THR 176 Ca -0.05 -2.28 0.01 0.00 0.31 0.00 0.00 61.69 59.68 1xck s THR 176 Cb -0.14 -2.24 0.02 0.00 0.01 0.00 0.00 72.50 70.15 1xck s THR 176 CO 0.05 -0.31 -0.07 -0.69 -0.69 0.00 0.00 174.62 172.91 1xck s VAL 177 N -2.25 0.69 0.22 3.82 1.01 -1.26 -0.74 120.40 121.88 1xck s VAL 177 Ca 0.27 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.04 1xck s VAL 177 Cb -0.06 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1xck s VAL 177 CO 0.13 0.25 0.07 -1.61 0.00 0.00 0.00 175.10 173.95 1xck s GLU 178 N 0.80 1.27 0.55 2.72 2.02 0.14 -4.95 118.70 121.24 1xck s GLU 178 Ca -0.12 -1.66 -0.21 0.00 0.02 0.00 0.00 54.97 53.00 1xck s GLU 178 Cb -0.15 -0.16 -0.05 0.00 0.10 0.00 0.00 34.13 33.88 1xck s GLU 178 CO 0.01 -0.26 1.27 -0.51 0.02 0.00 0.00 175.26 175.79 1xck s ASP 179 N -3.24 5.34 0.52 -0.19 1.01 -1.26 -1.93 116.67 116.92 1xck s ASP 179 Ca 0.33 2.55 -0.10 0.00 0.71 0.00 0.00 52.55 56.04 1xck s ASP 179 Cb 0.07 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 1xck s ASP 179 CO 0.10 -1.50 0.90 -0.83 0.21 0.00 0.00 175.17 174.05 1xck s GLY 180 N -1.26 1.75 0.31 0.21 0.00 -0.42 -4.47 107.32 103.43 1xck s GLY 180 Ca 0.73 -0.18 0.16 0.00 0.00 0.00 0.00 44.72 45.44 1xck s GLY 180 CO 0.40 0.05 1.54 -0.91 0.00 0.00 0.00 173.10 174.18 1xck h THR 181 N 0.34 0.90 0.00 0.90 1.35 -1.88 -3.48 112.91 111.03 1xck h THR 181 Ca -0.46 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.37 1xck h THR 181 Cb 1.19 2.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 1xck h THR 181 CO 0.62 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.97 1xck n GLY 182 N 0.90 1.52 3.78 5.82 0.00 -1.26 -5.11 105.19 110.84 1xck n GLY 182 Ca 0.01 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 1xck n GLY 182 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xck s LEU 183 N 0.00 4.30 0.00 0.99 1.98 -1.17 -2.59 118.68 122.20 1xck s LEU 183 Ca 0.00 1.97 0.00 0.00 -2.89 0.00 0.00 54.13 53.21 1xck s LEU 183 Cb 0.00 -4.02 0.00 0.00 0.66 0.00 0.00 46.19 42.83 1xck s LEU 183 CO 0.00 -0.23 0.00 0.00 -1.89 0.00 0.00 176.35 174.23 1xck n GLN 184 N 0.43 0.00 -1.13 1.98 6.02 -1.26 -4.78 117.38 118.65 1xck n GLN 184 Ca 0.03 0.14 -0.28 0.00 -0.01 0.00 0.00 57.00 56.87 1xck n GLN 184 Cb 0.49 0.00 0.19 0.00 1.02 0.00 0.00 30.24 31.94 1xck n GLN 184 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xck s ASP 185 N -0.21 2.41 -0.07 1.08 1.01 -1.26 -4.13 116.67 115.50 1xck s ASP 185 Ca 0.00 1.18 -0.09 0.00 0.71 0.00 0.00 52.55 54.35 1xck s ASP 185 Cb 0.00 -1.85 0.02 0.00 1.01 0.00 0.00 42.92 42.10 1xck s ASP 185 CO 0.00 -3.26 0.24 -1.61 0.21 0.00 0.00 175.17 170.74 1xck s GLU 186 N -4.94 0.34 -0.01 8.23 2.02 -0.39 -4.89 118.70 119.06 1xck s GLU 186 Ca 0.66 0.21 0.01 0.00 0.02 0.00 0.00 54.97 55.86 1xck s GLU 186 Cb -0.19 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.20 1xck s GLU 186 CO 0.58 -0.06 -0.03 -1.17 0.02 0.00 0.00 175.26 174.61 1xck s LEU 187 N -0.17 1.84 -0.29 1.80 2.96 -1.26 -0.64 118.68 122.93 1xck s LEU 187 Ca -0.03 -0.06 -0.19 0.00 -0.22 0.00 0.00 54.13 53.64 1xck s LEU 187 Cb -0.03 -0.19 0.16 0.00 0.50 0.00 0.00 46.19 46.64 1xck s LEU 187 CO 0.01 0.01 1.10 1.51 -1.32 0.00 0.00 176.35 177.66 1xck s ASP 188 N 0.14 -0.35 -0.15 3.68 -4.77 -1.09 -4.98 116.67 109.16 1xck s ASP 188 Ca -0.01 0.59 -0.25 0.00 -3.30 0.00 0.00 52.55 49.59 1xck s ASP 188 Cb -0.04 0.98 -0.02 0.00 -1.09 0.00 0.00 42.92 42.76 1xck s ASP 188 CO -0.00 -0.10 0.79 -0.69 0.70 0.00 0.00 175.17 175.87 1xck s VAL 189 N 0.93 4.92 0.29 2.11 1.01 -1.26 -1.64 120.40 126.76 1xck s VAL 189 Ca -0.05 1.57 0.11 0.00 0.00 0.00 0.00 61.98 63.60 1xck s VAL 189 Cb -0.04 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1xck s VAL 189 CO -0.12 0.08 -0.10 0.68 0.00 0.00 0.00 175.10 175.64 1xck s VAL 190 N 1.85 2.81 0.19 2.92 -7.23 0.68 -4.87 120.40 116.74 1xck s VAL 190 Ca 0.38 -2.17 -0.33 0.00 -1.81 0.00 0.00 61.98 58.05 1xck s VAL 190 Cb -0.17 -2.57 -0.13 0.00 0.56 0.00 0.00 36.38 34.07 1xck s VAL 190 CO 0.14 -0.35 1.61 -0.62 -0.31 0.00 0.00 175.10 175.57 1xck n GLU 191 N -0.77 2.38 0.00 4.82 -0.58 -1.26 -0.99 120.64 124.23 1xck n GLU 191 Ca -0.05 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.54 1xck n GLU 191 Cb 0.60 -2.64 0.00 0.00 -0.57 0.00 0.00 31.44 28.83 1xck n GLU 191 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xck n GLY 192 N 3.41 -0.06 3.66 0.62 0.00 -1.26 0.74 105.19 112.30 1xck n GLY 192 Ca 0.16 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 1xck n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xck s MET 193 N -2.00 1.56 -0.17 1.61 1.75 -0.74 -3.82 119.30 117.50 1xck s MET 193 Ca 0.00 -0.92 -0.06 0.00 -1.25 0.00 0.00 55.69 53.46 1xck s MET 193 Cb 0.00 0.56 0.08 0.00 2.84 0.00 0.00 34.83 38.31 1xck s MET 193 CO 0.00 -0.69 0.35 -1.14 -0.65 0.00 0.00 175.02 172.90 1xck s GLN 194 N -3.90 0.26 0.32 4.11 0.74 -1.26 -0.32 119.66 119.62 1xck s GLN 194 Ca 0.11 0.88 0.09 0.00 0.05 0.00 0.00 55.36 56.49 1xck s GLN 194 Cb -0.03 0.14 -0.05 0.00 1.10 0.00 0.00 33.01 34.17 1xck s GLN 194 CO 0.02 -0.25 0.00 -0.59 -0.55 0.00 0.00 175.29 173.92 1xck s PHE 195 N 2.34 2.57 -1.22 1.67 -0.71 -0.36 -4.99 117.98 117.28 1xck s PHE 195 Ca -0.02 -0.37 -0.14 0.00 -1.04 0.00 0.00 56.93 55.35 1xck s PHE 195 Cb -0.12 -1.39 0.16 0.00 -1.21 0.00 0.00 43.02 40.46 1xck s PHE 195 CO -0.11 0.52 1.47 -0.51 -1.34 0.00 0.00 175.22 175.25 1xck s ASP 196 N -3.70 7.04 -0.18 1.98 1.01 -1.26 -1.80 116.67 119.75 1xck s ASP 196 Ca 0.34 -2.93 -0.13 0.00 0.71 0.00 0.00 52.55 50.54 1xck s ASP 196 Cb -0.02 -2.42 0.05 0.00 1.01 0.00 0.00 42.92 41.54 1xck s ASP 196 CO 0.19 -0.80 0.47 -0.13 0.21 0.00 0.00 175.17 175.11 1xck s ARG 197 N 1.91 0.50 0.00 8.23 1.81 -1.09 -4.87 118.95 125.44 1xck s ARG 197 Ca 0.44 0.77 0.00 0.00 -1.72 0.00 0.00 55.73 55.22 1xck s ARG 197 Cb -0.02 0.13 0.00 0.00 -0.45 0.00 0.00 34.95 34.61 1xck s ARG 197 CO 0.01 -0.11 0.00 0.41 -0.68 0.00 0.00 175.30 174.93 1xck n GLY 198 N 3.57 2.12 3.74 -3.53 0.00 -1.24 -1.22 105.19 108.65 1xck n GLY 198 Ca -0.18 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.31 1xck n GLY 198 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xck s TYR 199 N 1.00 3.34 -1.38 1.61 -0.85 -0.70 -4.43 117.35 115.95 1xck s TYR 199 Ca 0.00 1.39 0.00 0.00 -0.52 0.00 0.00 57.07 57.94 1xck s TYR 199 Cb 0.00 -3.51 0.00 0.00 0.38 0.00 0.00 41.96 38.83 1xck s TYR 199 CO 0.00 -1.45 0.39 1.28 -1.52 0.00 0.00 175.55 174.25 1xck n LEU 200 N 2.14 0.35 0.00 -3.49 4.77 -0.62 -4.68 117.00 115.48 1xck n LEU 200 Ca 0.04 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1xck n LEU 200 Cb 0.44 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1xck n LEU 200 CO 0.57 0.09 0.00 -0.24 -1.33 0.00 0.00 177.39 176.47 1xck n SER 201 N -0.05 0.00 -3.76 -1.43 2.88 -1.26 -5.07 113.62 104.92 1xck n SER 201 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xck n SER 201 Cb 0.09 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1xck n SER 201 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1xck n PRO 202 N -0.75 2.16 0.00 -1.46 -0.02 -1.26 -3.77 135.00 129.91 1xck n PRO 202 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1xck n PRO 202 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1xck n PRO 202 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xck n TYR 203 N -0.05 0.00 0.29 6.00 4.01 -1.26 -4.35 117.16 121.80 1xck n TYR 203 Ca 0.00 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.91 1xck n TYR 203 Cb 0.00 0.00 0.81 0.00 -0.31 0.00 0.00 39.34 39.84 1xck n TYR 203 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 1xck h PHE 204 N 0.00 0.00 -2.49 -0.72 0.04 -1.91 -3.42 116.94 108.44 1xck h PHE 204 Ca 0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 1xck h PHE 204 Cb 0.00 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.17 1xck h PHE 204 CO 0.00 0.00 1.15 0.42 -0.60 0.00 0.00 178.31 179.28 1xck s ILE 205 N -3.73 2.92 -0.30 -0.55 1.01 -1.26 -4.66 121.20 114.63 1xck s ILE 205 Ca -0.01 0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.83 1xck s ILE 205 Cb 0.10 -3.11 0.01 0.00 0.01 0.00 0.00 42.46 39.47 1xck s ILE 205 CO 0.37 -0.01 0.51 -0.46 0.00 0.00 0.00 174.94 175.36 1xck n ASN 206 N 6.62 1.05 -3.40 3.58 0.23 -1.09 -4.73 115.26 117.53 1xck n ASN 206 Ca 0.18 -1.02 -0.26 0.00 -0.53 0.00 0.00 54.58 52.95 1xck n ASN 206 Cb 0.40 0.15 -0.08 0.00 -2.08 0.00 0.00 39.78 38.17 1xck n ASN 206 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1xck n LYS 207 N -0.04 1.95 0.24 -3.83 4.76 -0.85 -4.95 118.16 115.45 1xck n LYS 207 Ca 0.01 -4.25 0.11 0.00 -2.87 0.00 0.00 58.31 51.31 1xck n LYS 207 Cb 0.06 -1.98 0.59 0.00 -1.84 0.00 0.00 35.03 31.86 1xck n LYS 207 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1xck h PRO 208 N 4.27 0.00 0.10 1.97 0.13 -1.85 1.14 132.00 137.77 1xck h PRO 208 Ca 0.17 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.09 1xck h PRO 208 Cb 0.73 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.88 1xck h PRO 208 CO 0.72 0.00 -0.86 0.93 -0.23 0.00 0.00 178.00 178.56 1xck h GLU 209 N 0.00 0.41 0.00 0.86 3.07 -1.94 -3.21 114.58 113.77 1xck h GLU 209 Ca 0.00 -0.57 0.00 0.00 -0.50 0.00 0.00 59.36 58.29 1xck h GLU 209 Cb 0.58 0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 1xck h GLU 209 CO 0.00 1.24 -0.55 2.41 -1.40 0.00 0.00 179.01 180.71 1xck n THR 210 N -4.07 0.28 -2.60 1.13 -1.04 -0.06 -4.93 114.28 102.99 1xck n THR 210 Ca -0.13 -0.21 -0.20 0.00 -2.04 0.00 0.00 64.05 61.47 1xck n THR 210 Cb 0.82 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 1xck n THR 210 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xck n GLY 211 N 1.38 -0.51 3.49 3.41 0.00 0.38 -4.95 105.19 108.38 1xck n GLY 211 Ca 0.04 0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1xck n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xck s ALA 212 N -3.02 2.60 0.03 4.61 0.00 -1.02 -4.64 121.76 120.33 1xck s ALA 212 Ca 0.09 -1.87 -0.00 0.00 0.00 0.00 0.00 51.96 50.18 1xck s ALA 212 Cb -0.04 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 1xck s ALA 212 CO 0.11 -0.28 0.14 0.08 0.00 0.00 0.00 175.76 175.81 1xck s VAL 213 N -3.21 5.04 -0.23 0.00 1.01 -0.26 -2.00 120.40 120.75 1xck s VAL 213 Ca 0.33 -0.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 1xck s VAL 213 Cb 0.08 -3.39 0.11 0.00 0.00 0.00 0.00 36.38 33.18 1xck s VAL 213 CO 0.15 0.24 0.26 -0.70 0.00 0.00 0.00 175.10 175.05 1xck s GLU 214 N -2.12 0.24 -0.06 2.72 2.12 -1.26 -1.89 118.70 118.45 1xck s GLU 214 Ca 0.28 0.16 0.02 0.00 0.36 0.00 0.00 54.97 55.80 1xck s GLU 214 Cb -0.12 -1.00 -0.03 0.00 0.26 0.00 0.00 34.13 33.23 1xck s GLU 214 CO 0.20 -0.74 -0.10 -0.51 -0.54 0.00 0.00 175.26 173.58 1xck s LEU 215 N 2.36 2.98 -0.08 2.70 1.43 -0.88 -4.97 118.68 122.23 1xck s LEU 215 Ca 0.08 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1xck s LEU 215 Cb -0.15 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1xck s LEU 215 CO -0.17 0.36 -0.16 -1.61 0.23 0.00 0.00 176.35 175.00 1xck s GLU 216 N -0.77 2.79 -1.56 1.70 2.02 -1.26 -1.68 118.70 119.94 1xck s GLU 216 Ca 0.12 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.28 1xck s GLU 216 Cb -0.11 -2.43 0.09 0.00 0.10 0.00 0.00 34.13 31.78 1xck s GLU 216 CO 0.01 0.45 0.70 0.43 0.02 0.00 0.00 175.26 176.88 1xck n SER 217 N 2.80 -2.53 -4.92 -0.19 7.64 0.71 -4.58 113.62 112.55 1xck n SER 217 Ca -0.17 -0.96 -0.27 0.00 1.01 0.00 0.00 58.87 58.48 1xck n SER 217 Cb 0.52 -3.13 0.03 0.00 -1.01 0.00 0.00 64.21 60.62 1xck n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1xck s PRO 218 N -6.71 3.03 0.29 1.43 0.04 -1.15 -4.57 135.00 127.36 1xck s PRO 218 Ca 0.45 0.03 -0.05 0.00 0.04 0.00 0.00 61.00 61.47 1xck s PRO 218 Cb -0.24 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 1xck s PRO 218 CO 0.89 -0.61 0.56 -0.06 0.04 0.00 0.00 177.00 177.82 1xck s PHE 219 N -2.94 3.48 -0.11 0.56 0.08 -0.31 -3.03 117.98 115.70 1xck s PHE 219 Ca 0.53 0.66 0.01 0.00 0.12 0.00 0.00 56.93 58.25 1xck s PHE 219 Cb -0.10 -2.12 0.02 0.00 -0.57 0.00 0.00 43.02 40.25 1xck s PHE 219 CO 0.45 0.16 -0.13 0.42 -0.10 0.00 0.00 175.22 176.02 1xck s ILE 220 N -2.10 1.38 -0.34 0.64 1.01 -0.58 -0.84 121.20 120.36 1xck s ILE 220 Ca 0.44 -0.55 -0.13 0.00 0.00 0.00 0.00 60.65 60.41 1xck s ILE 220 Cb -0.11 -1.29 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 1xck s ILE 220 CO 0.30 0.42 0.26 -0.22 0.00 0.00 0.00 174.94 175.70 1xck s LEU 221 N 1.23 4.48 -0.49 2.97 2.96 0.30 -0.11 118.68 130.01 1xck s LEU 221 Ca -0.02 -0.36 -0.12 0.00 -0.22 0.00 0.00 54.13 53.41 1xck s LEU 221 Cb -0.14 -2.18 0.12 0.00 0.50 0.00 0.00 46.19 44.49 1xck s LEU 221 CO -0.05 -0.24 0.40 -0.76 -1.32 0.00 0.00 176.35 174.38 1xck s LEU 222 N 1.78 5.84 -0.24 -0.68 1.43 -1.26 -0.46 118.68 125.10 1xck s LEU 222 Ca 0.07 -1.83 0.02 0.00 -1.03 0.00 0.00 54.13 51.36 1xck s LEU 222 Cb -0.17 -2.09 0.05 0.00 0.03 0.00 0.00 46.19 44.01 1xck s LEU 222 CO 0.11 -0.74 -0.12 0.00 0.23 0.00 0.00 176.35 175.82 1xck s ALA 223 N 1.46 2.53 -1.34 4.21 0.00 -0.75 0.13 121.76 128.00 1xck s ALA 223 Ca 0.05 -1.60 -0.17 0.00 0.00 0.00 0.00 51.96 50.24 1xck s ALA 223 Cb -0.27 -1.51 0.06 0.00 0.00 0.00 0.00 23.12 21.40 1xck s ALA 223 CO 0.01 -0.94 1.86 -3.47 0.00 0.00 0.00 175.76 173.22 1xck n ASP 224 N 4.51 4.67 0.00 0.00 2.03 -0.73 -3.04 116.55 124.00 1xck n ASP 224 Ca -0.16 -2.90 0.00 0.00 0.52 0.00 0.00 54.79 52.25 1xck n ASP 224 Cb 0.45 -1.72 0.00 0.00 -0.72 0.00 0.00 41.12 39.12 1xck n ASP 224 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1xck n LYS 225 N 7.74 0.00 -2.44 -0.67 -0.00 -1.26 -4.09 118.16 117.43 1xck n LYS 225 Ca 0.50 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 58.40 1xck n LYS 225 Cb 0.44 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.43 1xck n LYS 225 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1xck s LYS 226 N -2.00 4.57 -0.30 -1.58 1.02 -1.26 -2.84 119.74 117.35 1xck s LYS 226 Ca 0.00 1.82 -0.02 0.00 0.02 0.00 0.00 55.97 57.79 1xck s LYS 226 Cb 0.00 -3.22 0.05 0.00 -0.52 0.00 0.00 37.83 34.14 1xck s LYS 226 CO 0.00 0.07 0.00 0.42 -0.92 0.00 0.00 175.35 174.92 1xck s ILE 227 N -0.58 2.98 -0.05 2.17 1.01 0.60 -4.94 121.20 122.39 1xck s ILE 227 Ca 0.48 -1.39 0.09 0.00 0.00 0.00 0.00 60.65 59.83 1xck s ILE 227 Cb -0.32 -2.72 -0.13 0.00 0.01 0.00 0.00 42.46 39.30 1xck s ILE 227 CO 0.39 -0.11 0.21 -1.20 0.00 0.00 0.00 174.94 174.23 1xck n SER 228 N 4.62 2.70 -4.11 3.58 7.64 -1.26 -0.40 113.62 126.39 1xck n SER 228 Ca -0.13 -0.07 -0.31 0.00 1.01 0.00 0.00 58.87 59.37 1xck n SER 228 Cb 0.43 1.36 -0.17 0.00 -1.01 0.00 0.00 64.21 64.83 1xck n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xck s ASN 229 N -2.90 2.78 0.00 6.43 0.01 -1.26 -0.66 114.94 119.35 1xck s ASN 229 Ca -0.03 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 1xck s ASN 229 Cb 0.06 -1.27 0.00 0.00 0.41 0.00 0.00 41.25 40.45 1xck s ASN 229 CO 0.37 0.04 0.41 0.00 -1.51 0.00 0.00 177.10 176.41 1xck n ILE 230 N 4.19 0.00 0.07 0.60 3.06 -1.26 -3.40 119.36 122.62 1xck n ILE 230 Ca -0.19 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 59.93 1xck n ILE 230 Cb 0.51 -0.41 -0.13 0.00 0.54 0.00 0.00 39.64 40.15 1xck n ILE 230 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 1xck h ARG 231 N 0.18 0.17 0.00 9.51 2.43 -1.96 -3.14 114.38 121.57 1xck h ARG 231 Ca 0.00 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 58.78 1xck h ARG 231 Cb 0.41 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1xck h ARG 231 CO 0.00 1.08 -0.44 0.93 -1.51 0.00 0.00 179.97 180.03 1xck h GLU 232 N 0.05 0.00 -0.01 0.20 5.08 -1.95 -3.31 114.58 114.63 1xck h GLU 232 Ca -0.14 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1xck h GLU 232 Cb 1.93 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.18 1xck h GLU 232 CO 0.16 0.44 -0.00 0.52 -1.00 0.00 0.00 179.01 179.14 1xck h MET 233 N 0.00 0.01 -0.34 2.33 2.86 -1.76 -3.27 114.93 114.76 1xck h MET 233 Ca -0.00 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1xck h MET 233 Cb 1.23 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.85 1xck h MET 233 CO 0.06 0.37 -0.20 1.28 1.06 0.00 0.00 176.91 179.48 1xck n LEU 234 N -4.90 -0.36 -0.27 1.22 4.77 -1.19 0.23 117.00 116.50 1xck n LEU 234 Ca -0.08 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 56.63 1xck n LEU 234 Cb 0.20 -0.08 0.38 0.00 -2.33 0.00 0.00 43.42 41.59 1xck n LEU 234 CO 0.34 -0.50 1.22 1.55 -1.33 0.00 0.00 177.39 178.67 1xck h PRO 235 N 0.00 0.66 0.03 3.23 0.13 -1.83 0.74 132.00 134.96 1xck h PRO 235 Ca 0.06 -0.04 -0.29 0.00 -0.87 0.00 0.00 66.00 64.86 1xck h PRO 235 Cb 0.14 -0.15 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1xck h PRO 235 CO -0.32 0.44 -1.58 0.28 -0.23 0.00 0.00 178.00 176.58 1xck h VAL 236 N 0.68 1.02 -0.06 1.56 2.07 -0.42 -3.16 116.25 117.93 1xck h VAL 236 Ca 0.45 -2.81 -0.09 0.00 0.82 0.00 0.00 66.70 65.07 1xck h VAL 236 Cb 0.75 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 1xck h VAL 236 CO -0.21 0.66 -0.39 -0.07 0.02 0.00 0.00 177.57 177.58 1xck h LEU 237 N 0.02 0.14 -0.05 2.57 3.38 -0.04 -2.56 115.31 118.77 1xck h LEU 237 Ca -0.24 -0.05 -0.24 0.00 0.09 0.00 0.00 57.88 57.44 1xck h LEU 237 Cb 1.97 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.68 1xck h LEU 237 CO 0.10 0.52 -1.07 -0.33 0.09 0.00 0.00 178.44 177.75 1xck h GLU 238 N 0.11 0.25 0.00 1.13 5.08 -0.99 -1.65 114.58 118.52 1xck h GLU 238 Ca 0.01 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 57.97 1xck h GLU 238 Cb 0.74 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 1xck h GLU 238 CO 0.06 1.11 -0.21 0.00 -1.00 0.00 0.00 179.01 178.97 1xck h ALA 239 N 0.75 1.28 0.00 3.43 0.00 -1.48 -2.17 119.26 121.06 1xck h ALA 239 Ca -0.09 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1xck h ALA 239 Cb 1.76 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1xck h ALA 239 CO 0.17 0.26 -1.06 0.28 0.00 0.00 0.00 179.25 178.90 1xck h VAL 240 N 0.00 0.47 -0.31 0.00 2.07 -1.37 -3.24 116.25 113.88 1xck h VAL 240 Ca -0.00 -1.83 -0.08 0.00 0.82 0.00 0.00 66.70 65.61 1xck h VAL 240 Cb 0.50 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1xck h VAL 240 CO 0.03 0.27 -0.16 0.00 0.02 0.00 0.00 177.57 177.72 1xck h ALA 241 N 1.57 1.14 -2.19 1.67 0.00 -0.69 -3.12 119.26 117.63 1xck h ALA 241 Ca -0.09 -0.31 -0.46 0.00 0.00 0.00 0.00 54.91 54.06 1xck h ALA 241 Cb 1.41 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1xck h ALA 241 CO 0.04 0.54 0.29 0.15 0.00 0.00 0.00 179.25 180.27 1xck s LYS 242 N -4.67 4.25 0.00 0.00 1.02 -0.92 -2.72 119.74 116.70 1xck s LYS 242 Ca -0.08 1.06 0.00 0.00 0.02 0.00 0.00 55.97 56.98 1xck s LYS 242 Cb 0.14 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1xck s LYS 242 CO 0.79 0.08 0.00 0.00 -0.92 0.00 0.00 175.35 175.30 1xck n ALA 243 N -0.32 0.00 -3.64 5.17 0.00 -1.26 -4.34 120.51 116.12 1xck n ALA 243 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.29 1xck n ALA 243 Cb 0.53 -0.10 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 1xck n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 244 N -2.07 -0.19 3.43 0.00 0.00 -1.10 -4.93 105.19 100.33 1xck n GLY 244 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1xck n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xck s LYS 245 N -5.74 1.81 0.96 1.61 1.02 -1.18 -5.08 119.74 113.14 1xck s LYS 245 Ca 0.08 -1.13 -0.12 0.00 0.02 0.00 0.00 55.97 54.83 1xck s LYS 245 Cb -0.05 -2.07 0.17 0.00 -0.52 0.00 0.00 37.83 35.36 1xck s LYS 245 CO 0.55 0.50 1.09 -1.25 -0.92 0.00 0.00 175.35 175.32 1xck s PRO 246 N -1.70 0.71 -0.01 -1.68 0.04 -1.26 -4.73 135.00 126.37 1xck s PRO 246 Ca 0.15 0.76 0.01 0.00 0.04 0.00 0.00 61.00 61.97 1xck s PRO 246 Cb -0.10 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1xck s PRO 246 CO 0.06 -2.60 -0.05 -1.17 0.04 0.00 0.00 177.00 173.28 1xck s LEU 247 N -6.44 1.85 -0.19 -3.56 2.96 0.94 -1.16 118.68 113.07 1xck s LEU 247 Ca 0.65 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 54.45 1xck s LEU 247 Cb -0.19 -0.28 0.00 0.00 0.50 0.00 0.00 46.19 46.22 1xck s LEU 247 CO 0.58 0.03 -0.11 -0.22 -1.32 0.00 0.00 176.35 175.31 1xck s LEU 248 N 0.11 2.58 -0.27 -0.68 2.96 -0.02 -0.24 118.68 123.12 1xck s LEU 248 Ca -0.01 -0.48 -0.11 0.00 -0.22 0.00 0.00 54.13 53.31 1xck s LEU 248 Cb -0.05 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.97 1xck s LEU 248 CO -0.00 0.01 0.18 -0.63 -1.32 0.00 0.00 176.35 174.58 1xck s ILE 249 N 1.27 5.31 -0.33 6.68 -1.09 0.35 -0.54 121.20 132.85 1xck s ILE 249 Ca 0.03 0.17 0.04 0.00 -2.23 0.00 0.00 60.65 58.66 1xck s ILE 249 Cb -0.14 -3.51 0.10 0.00 -1.58 0.00 0.00 42.46 37.33 1xck s ILE 249 CO -0.06 0.28 0.04 -0.63 -1.23 0.00 0.00 174.94 173.35 1xck s ILE 250 N 1.51 2.22 0.34 2.92 1.01 0.39 -0.86 121.20 128.74 1xck s ILE 250 Ca 0.07 -2.25 0.03 0.00 0.00 0.00 0.00 60.65 58.50 1xck s ILE 250 Cb -0.15 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 1xck s ILE 250 CO 0.09 -0.55 0.11 0.00 0.00 0.00 0.00 174.94 174.59 1xck s ALA 251 N 0.94 2.37 0.32 9.38 0.00 -1.16 -1.82 121.76 131.80 1xck s ALA 251 Ca 0.09 -1.67 0.08 0.00 0.00 0.00 0.00 51.96 50.46 1xck s ALA 251 Cb -0.19 0.87 0.79 0.00 0.00 0.00 0.00 23.12 24.60 1xck s ALA 251 CO -0.08 -0.39 1.79 1.49 0.00 0.00 0.00 175.76 178.56 1xck h GLU 252 N 2.06 0.69 0.00 0.00 4.81 -1.44 -0.42 114.58 120.28 1xck h GLU 252 Ca -0.37 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1xck h GLU 252 Cb 1.26 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1xck h GLU 252 CO 0.59 0.46 0.00 -3.47 -0.73 0.00 0.00 179.01 175.86 1xck n ASP 253 N -4.72 0.00 -4.00 1.04 2.03 -1.26 -4.36 116.55 105.28 1xck n ASP 253 Ca 0.23 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.23 1xck n ASP 253 Cb 0.60 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.84 1xck n ASP 253 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1xck s VAL 254 N -2.00 1.64 0.14 5.18 1.01 -1.26 -0.29 120.40 124.81 1xck s VAL 254 Ca 0.00 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1xck s VAL 254 Cb 0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1xck s VAL 254 CO 0.00 0.18 -0.02 -1.61 0.00 0.00 0.00 175.10 173.66 1xck s GLU 255 N 1.40 2.40 0.00 2.72 2.02 0.46 -4.65 118.70 123.06 1xck s GLU 255 Ca -0.01 -1.00 0.00 0.00 0.02 0.00 0.00 54.97 53.98 1xck s GLU 255 Cb -0.16 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.66 1xck s GLU 255 CO -0.08 0.49 0.00 0.41 0.02 0.00 0.00 175.26 176.10 1xck n GLY 256 N 0.24 0.00 0.33 -1.39 0.00 -1.26 -1.90 105.19 101.21 1xck n GLY 256 Ca -0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1xck n GLY 256 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xck h GLU 257 N 0.00 -0.01 -0.01 1.61 4.22 -1.92 1.24 114.58 119.71 1xck h GLU 257 Ca 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.38 1xck h GLU 257 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1xck h GLU 257 CO 0.00 -0.01 -0.23 0.00 -2.18 0.00 0.00 179.01 176.59 1xck h ALA 258 N 1.79 0.04 -0.20 2.92 0.00 -0.17 -2.91 119.26 120.73 1xck h ALA 258 Ca 0.41 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xck h ALA 258 Cb 0.64 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1xck h ALA 258 CO -0.91 0.07 0.09 1.25 0.00 0.00 0.00 179.25 179.75 1xck h LEU 259 N -0.49 0.14 -1.08 0.00 5.85 -1.10 -0.57 115.31 118.06 1xck h LEU 259 Ca -0.03 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1xck h LEU 259 Cb 0.97 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 1xck h LEU 259 CO 0.05 0.11 0.40 0.00 -0.34 0.00 0.00 178.44 178.65 1xck h ALA 260 N 1.10 1.29 -0.45 1.25 0.00 0.14 -0.08 119.26 122.52 1xck h ALA 260 Ca 0.08 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1xck h ALA 260 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1xck h ALA 260 CO -0.06 0.57 -0.12 1.15 0.00 0.00 0.00 179.25 180.79 1xck h THR 261 N 1.05 1.26 -0.21 0.00 2.02 -1.22 -2.49 112.91 113.31 1xck h THR 261 Ca 0.26 -1.19 -0.13 0.00 0.77 0.00 0.00 66.41 66.12 1xck h THR 261 Cb 0.04 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1xck h THR 261 CO -0.04 0.41 -0.38 -0.07 0.37 0.00 0.00 175.52 175.80 1xck h LEU 262 N 0.73 0.70 -2.43 2.58 3.38 -0.59 -1.52 115.31 118.17 1xck h LEU 262 Ca 0.12 -0.54 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1xck h LEU 262 Cb 0.61 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xck h LEU 262 CO 0.04 1.11 -0.00 0.58 0.09 0.00 0.00 178.44 180.26 1xck h VAL 263 N 0.32 0.56 0.00 1.22 2.07 -0.92 -2.55 116.25 116.95 1xck h VAL 263 Ca 0.01 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xck h VAL 263 Cb 0.98 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1xck h VAL 263 CO 0.09 0.00 -0.01 0.58 0.02 0.00 0.00 177.57 178.25 1xck h VAL 264 N 0.00 0.00 -0.99 2.57 2.07 -1.27 -3.24 116.25 115.39 1xck h VAL 264 Ca -0.00 -0.02 0.34 0.00 0.82 0.00 0.00 66.70 67.83 1xck h VAL 264 Cb 0.01 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.62 1xck h VAL 264 CO 0.00 0.00 0.51 0.78 0.02 0.00 0.00 177.57 178.88 1xck h ASN 265 N -0.02 0.38 0.66 0.57 -0.26 -1.30 0.41 115.58 116.02 1xck h ASN 265 Ca 0.00 0.21 -0.19 0.00 -0.56 0.00 0.00 56.30 55.76 1xck h ASN 265 Cb 0.01 0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 1xck h ASN 265 CO 0.00 -0.22 -0.87 0.71 -1.06 0.00 0.00 177.43 175.99 1xck h THR 266 N 0.22 1.52 0.00 2.81 1.35 -1.55 -0.23 112.91 117.04 1xck h THR 266 Ca 0.74 -2.69 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 1xck h THR 266 Cb 1.75 2.49 0.00 0.00 -1.73 0.00 0.00 68.15 70.66 1xck h THR 266 CO -0.66 0.78 0.00 0.80 -0.25 0.00 0.00 175.52 176.19 1xck n MET 267 N -3.63 0.86 0.00 4.72 0.00 0.14 -2.18 117.12 117.02 1xck n MET 267 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.67 1xck n MET 267 Cb 0.81 -1.16 0.00 0.00 0.00 0.00 0.00 33.22 32.86 1xck n MET 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1xck n ARG 268 N -0.66 0.68 -0.95 2.12 1.74 -0.80 -5.00 116.66 113.78 1xck n ARG 268 Ca 0.07 -0.74 0.00 0.00 -0.77 0.00 0.00 57.85 56.40 1xck n ARG 268 Cb 0.03 -0.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 1xck n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xck n GLY 269 N -0.17 0.82 2.28 -0.13 0.00 -0.93 -4.90 105.19 102.16 1xck n GLY 269 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1xck n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xck n ILE 270 N -2.14 4.16 -0.08 -0.61 5.41 -0.11 -4.75 119.36 121.24 1xck n ILE 270 Ca 0.00 -2.58 0.00 0.00 1.00 0.00 0.00 62.75 61.17 1xck n ILE 270 Cb 0.01 -2.42 0.00 0.00 -0.71 0.00 0.00 39.64 36.52 1xck n ILE 270 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1xck n VAL 271 N 3.11 -0.69 -2.75 1.39 0.31 -1.26 -4.52 118.33 113.92 1xck n VAL 271 Ca 0.70 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.61 1xck n VAL 271 Cb 0.36 -0.69 -0.03 0.00 -0.91 0.00 0.00 33.84 32.57 1xck n VAL 271 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1xck s LYS 272 N -4.01 4.31 0.02 5.55 3.01 -1.26 -3.80 119.74 123.55 1xck s LYS 272 Ca 0.00 1.24 0.01 0.00 -1.01 0.00 0.00 55.97 56.21 1xck s LYS 272 Cb 0.00 -3.60 -0.02 0.00 -1.01 0.00 0.00 37.83 33.21 1xck s LYS 272 CO 0.00 -0.45 -0.04 0.08 0.51 0.00 0.00 175.35 175.45 1xck s VAL 273 N 2.56 0.24 -0.03 3.17 1.01 -1.26 -0.04 120.40 126.06 1xck s VAL 273 Ca 0.43 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 1xck s VAL 273 Cb -0.16 -0.32 0.02 0.00 0.00 0.00 0.00 36.38 35.92 1xck s VAL 273 CO 0.11 -0.30 0.07 0.00 0.00 0.00 0.00 175.10 174.98 1xck s ALA 274 N -1.01 -0.11 0.04 5.51 0.00 0.67 -4.90 121.76 121.96 1xck s ALA 274 Ca -0.09 0.34 0.09 0.00 0.00 0.00 0.00 51.96 52.30 1xck s ALA 274 Cb -0.07 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 1xck s ALA 274 CO -0.00 -0.09 -0.25 0.00 0.00 0.00 0.00 175.76 175.42 1xck s ALA 275 N 0.65 2.11 0.05 0.00 0.00 -1.26 0.13 121.76 123.43 1xck s ALA 275 Ca -0.05 -1.20 -0.11 0.00 0.00 0.00 0.00 51.96 50.60 1xck s ALA 275 Cb -0.07 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.62 1xck s ALA 275 CO -0.02 0.49 0.24 0.14 0.00 0.00 0.00 175.76 176.61 1xck s VAL 276 N -0.79 0.10 0.46 0.00 -7.23 -0.04 -1.59 120.40 111.32 1xck s VAL 276 Ca 0.10 -0.86 -0.21 0.00 -1.81 0.00 0.00 61.98 59.21 1xck s VAL 276 Cb -0.10 -0.99 -0.09 0.00 0.56 0.00 0.00 36.38 35.76 1xck s VAL 276 CO 0.02 -0.47 1.04 -0.54 -0.31 0.00 0.00 175.10 174.83 1xck s LYS 277 N -2.79 3.92 0.54 4.82 1.02 -1.26 -2.98 119.74 123.01 1xck s LYS 277 Ca -0.03 1.39 -0.21 0.00 0.02 0.00 0.00 55.97 57.14 1xck s LYS 277 Cb -0.00 -2.21 -0.05 0.00 -0.52 0.00 0.00 37.83 35.05 1xck s LYS 277 CO -0.05 -0.33 1.23 0.00 -0.92 0.00 0.00 175.35 175.27 1xck s ALA 278 N -1.91 2.74 0.41 5.17 0.00 -0.17 -4.82 121.76 123.19 1xck s ALA 278 Ca 0.65 1.06 -0.25 0.00 0.00 0.00 0.00 51.96 53.41 1xck s ALA 278 Cb -0.17 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.41 1xck s ALA 278 CO 0.21 -1.05 1.22 -1.25 0.00 0.00 0.00 175.76 174.89 1xck s PRO 279 N -3.05 3.96 1.36 0.00 0.04 -1.26 -4.84 135.00 131.21 1xck s PRO 279 Ca 0.72 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.71 1xck s PRO 279 Cb -0.32 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1xck s PRO 279 CO 0.37 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.38 1xck n GLY 280 N 0.63 -1.56 3.26 0.56 0.00 -1.26 -4.33 105.19 102.49 1xck n GLY 280 Ca 0.05 -1.22 -0.15 0.00 0.00 0.00 0.00 46.02 44.70 1xck n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xck s PHE 281 N -0.19 1.39 0.00 1.61 -0.71 -1.26 -4.73 117.98 114.08 1xck s PHE 281 Ca 0.00 -1.48 0.00 0.00 -1.04 0.00 0.00 56.93 54.41 1xck s PHE 281 Cb 0.00 -0.58 0.00 0.00 -1.21 0.00 0.00 43.02 41.23 1xck s PHE 281 CO 0.00 -0.78 0.00 0.41 -1.34 0.00 0.00 175.22 173.51 1xck n GLY 282 N -0.44 3.31 0.15 1.99 0.00 -1.26 -2.33 105.19 106.61 1xck n GLY 282 Ca 0.04 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1xck n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xck h ASP 283 N 1.26 -0.22 0.00 1.61 3.32 -2.01 -3.12 116.42 117.26 1xck h ASP 283 Ca 0.00 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1xck h ASP 283 Cb 0.00 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1xck h ASP 283 CO 0.00 0.29 0.27 0.08 -1.72 0.00 0.00 179.24 178.16 1xck h ARG 284 N -0.85 0.00 0.05 3.56 -0.00 -1.95 0.42 114.38 115.61 1xck h ARG 284 Ca -0.03 0.00 -0.24 0.00 -0.00 0.00 0.00 59.98 59.72 1xck h ARG 284 Cb 0.52 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.51 1xck h ARG 284 CO 0.04 0.00 -0.96 -0.09 -0.00 0.00 0.00 179.97 178.97 1xck h ARG 285 N 0.00 0.55 -0.36 0.08 2.43 -1.40 -2.59 114.38 113.09 1xck h ARG 285 Ca 0.00 -0.67 -0.10 0.00 -0.81 0.00 0.00 59.98 58.40 1xck h ARG 285 Cb 0.53 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 1xck h ARG 285 CO 0.00 1.27 -0.18 0.87 -1.51 0.00 0.00 179.97 180.43 1xck h LYS 286 N 0.13 0.75 -0.44 0.20 1.57 -0.23 -1.51 116.57 117.04 1xck h LYS 286 Ca -0.14 -0.33 0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1xck h LYS 286 Cb 1.65 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.91 1xck h LYS 286 CO 0.19 0.94 0.25 0.00 -0.57 0.00 0.00 179.45 180.26 1xck h ALA 287 N 0.79 0.56 0.00 3.86 0.00 -1.38 -2.16 119.26 120.93 1xck h ALA 287 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1xck h ALA 287 Cb 0.72 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1xck h ALA 287 CO 0.05 -0.09 -0.38 0.52 0.00 0.00 0.00 179.25 179.35 1xck h MET 288 N 0.49 0.00 0.00 0.00 2.86 -1.35 -1.94 114.93 115.00 1xck h MET 288 Ca 0.18 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.76 1xck h MET 288 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1xck h MET 288 CO -0.10 0.38 -0.28 -0.07 1.06 0.00 0.00 176.91 177.90 1xck h LEU 289 N 0.00 0.00 0.02 1.22 3.38 -0.64 -1.90 115.31 117.39 1xck h LEU 289 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 1xck h LEU 289 Cb 0.71 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.47 1xck h LEU 289 CO 0.05 0.28 -0.60 -0.61 0.09 0.00 0.00 178.44 177.65 1xck h GLN 290 N 0.00 0.37 -0.63 1.13 5.75 -0.98 -2.74 115.11 118.02 1xck h GLN 290 Ca -0.00 -0.43 0.13 0.00 -0.15 0.00 0.00 58.65 58.20 1xck h GLN 290 Cb 0.58 0.13 -0.10 0.00 1.07 0.00 0.00 27.48 29.15 1xck h GLN 290 CO 0.04 1.11 0.01 -0.44 -2.65 0.00 0.00 178.83 176.90 1xck h ASP 291 N -0.18 -0.26 -0.88 -0.69 5.19 -0.91 0.23 116.42 118.92 1xck h ASP 291 Ca -0.08 0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.48 1xck h ASP 291 Cb 1.34 0.27 -0.04 0.00 0.18 0.00 0.00 39.33 41.07 1xck h ASP 291 CO 0.12 -0.11 0.52 0.40 -3.12 0.00 0.00 179.24 177.05 1xck h ILE 292 N 0.13 1.25 0.11 0.35 2.04 -1.40 -1.30 117.51 118.68 1xck h ILE 292 Ca 0.33 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1xck h ILE 292 Cb 0.54 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 1xck h ILE 292 CO -0.53 0.26 -0.06 0.00 0.00 0.00 0.00 178.15 177.82 1xck h ALA 293 N 1.28 -0.16 -0.72 1.87 0.00 -0.33 0.18 119.26 121.39 1xck h ALA 293 Ca 0.32 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1xck h ALA 293 Cb -0.03 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1xck h ALA 293 CO -0.06 -0.59 0.41 1.15 0.00 0.00 0.00 179.25 180.16 1xck h THR 294 N -0.17 1.21 -0.32 0.00 2.02 -0.75 1.39 112.91 116.29 1xck h THR 294 Ca -0.01 -0.51 -0.15 0.00 0.77 0.00 0.00 66.41 66.52 1xck h THR 294 Cb 0.14 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1xck h THR 294 CO 0.01 0.23 -0.39 0.25 0.37 0.00 0.00 175.52 175.99 1xck h LEU 295 N 1.00 0.81 -1.10 2.58 7.12 -0.86 -3.18 115.31 121.69 1xck h LEU 295 Ca 0.26 -0.37 0.00 0.00 0.13 0.00 0.00 57.88 57.90 1xck h LEU 295 Cb 0.00 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 39.91 1xck h LEU 295 CO -0.04 1.11 -0.38 0.35 -0.13 0.00 0.00 178.44 179.35 1xck n THR 296 N -4.04 0.00 -3.14 1.05 -2.24 0.62 -1.47 114.28 105.05 1xck n THR 296 Ca -0.02 -0.28 -0.14 0.00 -2.27 0.00 0.00 64.05 61.33 1xck n THR 296 Cb 0.53 1.20 0.05 0.00 -2.10 0.00 0.00 70.33 70.01 1xck n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xck n GLY 297 N 1.40 0.01 3.78 3.38 0.00 0.45 -0.32 105.19 113.89 1xck n GLY 297 Ca 0.10 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1xck n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xck s GLY 298 N -3.28 2.91 -0.11 -0.02 0.00 0.54 -4.49 107.32 102.87 1xck s GLY 298 Ca 0.32 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.50 1xck s GLY 298 CO 0.45 -2.16 -0.19 -1.59 0.00 0.00 0.00 173.10 169.62 1xck s THR 299 N -2.86 2.56 -0.05 0.90 2.01 0.30 -4.48 115.64 114.03 1xck s THR 299 Ca 0.11 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 1xck s THR 299 Cb 0.01 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 1xck s THR 299 CO 0.06 0.55 1.08 -0.69 -0.69 0.00 0.00 174.62 174.93 1xck s VAL 300 N 0.23 4.55 -0.76 3.82 1.01 -1.26 -4.50 120.40 123.49 1xck s VAL 300 Ca -0.12 1.84 -0.17 0.00 0.00 0.00 0.00 61.98 63.53 1xck s VAL 300 Cb -0.16 -4.18 0.15 0.00 0.00 0.00 0.00 36.38 32.18 1xck s VAL 300 CO 0.07 0.05 0.84 -0.63 0.00 0.00 0.00 175.10 175.42 1xck s ILE 301 N 1.77 5.03 -0.16 2.22 1.01 0.12 -4.94 121.20 126.25 1xck s ILE 301 Ca 0.52 -1.60 -0.06 0.00 0.00 0.00 0.00 60.65 59.52 1xck s ILE 301 Cb -0.22 -4.57 -0.04 0.00 0.01 0.00 0.00 42.46 37.65 1xck s ILE 301 CO 0.22 -1.21 0.06 -0.94 0.00 0.00 0.00 174.94 173.08 1xck s SER 302 N 3.20 5.64 0.50 3.58 1.04 -1.26 -1.77 113.70 124.63 1xck s SER 302 Ca 0.19 0.14 0.20 0.00 0.48 0.00 0.00 55.95 56.96 1xck s SER 302 Cb -0.15 -1.89 1.26 0.00 0.10 0.00 0.00 66.02 65.35 1xck s SER 302 CO -0.03 0.24 2.08 -0.33 0.98 0.00 0.00 173.24 176.18 1xck h GLU 303 N 6.19 0.00 0.20 4.02 5.08 -1.78 -2.69 114.58 125.60 1xck h GLU 303 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1xck h GLU 303 Cb 1.18 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.39 1xck h GLU 303 CO 0.66 0.11 -0.48 0.93 -1.00 0.00 0.00 179.01 179.23 1xck h GLU 304 N 0.00 -0.72 0.00 2.33 5.08 -1.91 0.39 114.58 119.75 1xck h GLU 304 Ca -0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1xck h GLU 304 Cb 0.22 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1xck h GLU 304 CO 0.01 -0.48 0.00 -0.89 -1.00 0.00 0.00 179.01 176.65 1xck n ILE 305 N -5.20 0.00 -2.34 3.13 5.41 -1.13 -4.81 119.36 114.43 1xck n ILE 305 Ca -0.09 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.62 1xck n ILE 305 Cb 0.39 -0.81 0.02 0.00 -0.71 0.00 0.00 39.64 38.53 1xck n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xck n GLY 306 N -0.36 0.26 3.83 7.39 0.00 0.14 -5.07 105.19 111.38 1xck n GLY 306 Ca 0.07 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 1xck n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xck s MET 307 N -4.33 2.70 0.01 1.61 -1.94 -1.03 -5.01 119.30 111.31 1xck s MET 307 Ca 0.00 -1.29 0.01 0.00 -1.71 0.00 0.00 55.69 52.70 1xck s MET 307 Cb -0.00 -2.45 -0.01 0.00 2.01 0.00 0.00 34.83 34.38 1xck s MET 307 CO 0.17 0.15 -0.05 -1.21 -0.01 0.00 0.00 175.02 174.07 1xck s GLU 308 N -3.95 0.35 0.48 2.03 2.02 -1.26 -4.46 118.70 113.92 1xck s GLU 308 Ca 0.39 -0.32 0.27 0.00 0.02 0.00 0.00 54.97 55.33 1xck s GLU 308 Cb -0.06 -0.25 1.09 0.00 0.10 0.00 0.00 34.13 35.01 1xck s GLU 308 CO 0.26 0.06 1.89 -0.07 0.02 0.00 0.00 175.26 177.42 1xck h LEU 309 N 5.56 0.00 -1.06 1.80 3.38 -1.95 -2.52 115.31 120.52 1xck h LEU 309 Ca -0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1xck h LEU 309 Cb 1.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xck h LEU 309 CO 0.47 0.14 -0.05 -0.33 0.09 0.00 0.00 178.44 178.77 1xck h GLU 310 N 0.00 0.00 -0.35 1.13 3.07 -1.93 -2.87 114.58 113.62 1xck h GLU 310 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xck h GLU 310 Cb 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1xck h GLU 310 CO 0.02 0.05 0.00 1.63 -1.40 0.00 0.00 179.01 179.30 1xck n LYS 311 N -3.14 3.15 -3.34 2.33 5.02 -0.96 -4.82 118.16 116.40 1xck n LYS 311 Ca 0.01 -2.66 -0.38 0.00 -2.02 0.00 0.00 58.31 53.27 1xck n LYS 311 Cb 0.38 -1.73 -0.06 0.00 -0.02 0.00 0.00 35.03 33.60 1xck n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xck s ALA 312 N -2.22 3.51 0.37 7.82 0.00 -1.08 -4.96 121.76 125.20 1xck s ALA 312 Ca 0.39 -0.28 0.08 0.00 0.00 0.00 0.00 51.96 52.14 1xck s ALA 312 Cb 0.29 -2.63 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 1xck s ALA 312 CO 0.13 -0.07 0.28 0.95 0.00 0.00 0.00 175.76 177.05 1xck s THR 313 N 0.80 3.00 0.56 0.00 -4.23 -1.26 -4.39 115.64 110.12 1xck s THR 313 Ca 0.24 -1.46 0.31 0.00 -1.18 0.00 0.00 61.69 59.60 1xck s THR 313 Cb -0.15 -3.06 0.45 0.00 1.34 0.00 0.00 72.50 71.09 1xck s THR 313 CO 0.09 -0.10 1.84 -0.07 -0.54 0.00 0.00 174.62 175.85 1xck h LEU 314 N 1.25 0.00 -1.82 4.79 3.38 -1.93 0.18 115.31 121.17 1xck h LEU 314 Ca -0.43 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 1xck h LEU 314 Cb 1.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1xck h LEU 314 CO 0.60 0.00 -0.08 -0.08 0.09 0.00 0.00 178.44 178.97 1xck h GLU 315 N 0.00 0.01 0.00 1.13 4.81 -2.00 -2.13 114.58 116.39 1xck h GLU 315 Ca 0.37 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.52 1xck h GLU 315 Cb 1.67 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.04 1xck h GLU 315 CO -0.00 0.09 -0.45 -0.44 -0.73 0.00 0.00 179.01 177.47 1xck h ASP 316 N 0.01 0.00 -3.92 1.04 3.32 -1.00 -3.44 116.42 112.43 1xck h ASP 316 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1xck h ASP 316 Cb 0.15 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.77 1xck h ASP 316 CO 0.01 0.38 0.59 -0.76 -1.72 0.00 0.00 179.24 177.75 1xck s LEU 317 N -6.34 4.29 0.00 1.55 1.02 -0.80 0.11 118.68 118.51 1xck s LEU 317 Ca 0.04 2.59 -0.10 0.00 0.02 0.00 0.00 54.13 56.68 1xck s LEU 317 Cb 0.07 -3.83 0.15 0.00 0.02 0.00 0.00 46.19 42.59 1xck s LEU 317 CO 0.73 -0.68 0.87 0.61 0.02 0.00 0.00 176.35 177.90 1xck n GLY 318 N 0.73 -1.18 3.62 -3.19 0.00 0.84 -4.38 105.19 101.61 1xck n GLY 318 Ca 0.02 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 1xck n GLY 318 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xck s GLN 319 N -4.88 0.79 0.06 1.61 0.74 0.56 -1.53 119.66 117.02 1xck s GLN 319 Ca 0.50 0.81 -0.12 0.00 0.05 0.00 0.00 55.36 56.60 1xck s GLN 319 Cb -0.01 0.39 0.01 0.00 1.10 0.00 0.00 33.01 34.50 1xck s GLN 319 CO 0.35 -0.12 0.28 0.00 -0.55 0.00 0.00 175.29 175.24 1xck s ALA 320 N 0.13 -0.57 0.36 1.58 0.00 -1.17 -0.15 121.76 121.93 1xck s ALA 320 Ca -0.01 -0.18 0.14 0.00 0.00 0.00 0.00 51.96 51.91 1xck s ALA 320 Cb -0.04 0.40 0.74 0.00 0.00 0.00 0.00 23.12 24.22 1xck s ALA 320 CO 0.01 -0.46 1.83 0.87 0.00 0.00 0.00 175.76 178.00 1xck h LYS 321 N 3.03 0.00 -1.55 0.00 1.57 -0.48 -3.04 116.57 116.09 1xck h LYS 321 Ca -0.33 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.53 1xck h LYS 321 Cb 1.21 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.25 1xck h LYS 321 CO 0.49 0.37 0.50 0.50 -0.57 0.00 0.00 179.45 180.74 1xck s ARG 322 N -4.13 0.49 0.01 3.15 3.52 -0.99 -0.21 118.95 120.78 1xck s ARG 322 Ca -0.03 0.49 0.03 0.00 -0.13 0.00 0.00 55.73 56.10 1xck s ARG 322 Cb 0.14 0.24 -0.01 0.00 -1.56 0.00 0.00 34.95 33.75 1xck s ARG 322 CO 0.72 -0.08 -0.10 0.14 -0.81 0.00 0.00 175.30 175.17 1xck s VAL 323 N 0.01 0.81 -0.07 7.11 -7.23 -0.68 0.21 120.40 120.56 1xck s VAL 323 Ca 0.03 -0.65 0.02 0.00 -1.81 0.00 0.00 61.98 59.56 1xck s VAL 323 Cb -0.04 -0.72 0.01 0.00 0.56 0.00 0.00 36.38 36.19 1xck s VAL 323 CO -0.06 0.07 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.00 1xck s VAL 324 N -0.54 1.14 -0.04 1.32 1.01 -0.51 -2.07 120.40 120.70 1xck s VAL 324 Ca 0.01 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1xck s VAL 324 Cb -0.06 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 1xck s VAL 324 CO 0.00 0.36 -0.22 -0.63 0.00 0.00 0.00 175.10 174.61 1xck s ILE 325 N 0.72 2.37 0.00 2.22 1.01 -0.79 -0.82 121.20 125.91 1xck s ILE 325 Ca -0.14 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.54 1xck s ILE 325 Cb -0.16 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.44 1xck s ILE 325 CO 0.03 0.58 0.00 0.59 0.00 0.00 0.00 174.94 176.14 1xck n ASN 326 N 2.59 0.80 0.09 3.58 3.02 0.28 -1.10 115.26 124.52 1xck n ASN 326 Ca -0.17 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.32 1xck n ASN 326 Cb 0.52 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.71 1xck n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1xck h LYS 327 N 0.00 0.14 0.00 3.52 3.64 -1.92 -1.85 116.57 120.10 1xck h LYS 327 Ca 0.00 -0.14 -0.14 0.00 -1.27 0.00 0.00 60.65 59.10 1xck h LYS 327 Cb 0.00 0.04 -0.27 0.00 -0.41 0.00 0.00 32.23 31.58 1xck h LYS 327 CO 0.00 0.87 -0.78 -0.40 -2.27 0.00 0.00 179.45 176.87 1xck n ASP 328 N -3.68 0.44 -3.68 4.20 5.68 -1.26 -3.60 116.55 114.64 1xck n ASP 328 Ca -0.03 -1.96 -0.10 0.00 -0.50 0.00 0.00 54.79 52.21 1xck n ASP 328 Cb 0.76 -0.16 -0.10 0.00 -1.14 0.00 0.00 41.12 40.49 1xck n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1xck s THR 329 N 0.00 -0.16 -0.15 2.12 2.01 -0.73 -2.65 115.64 116.08 1xck s THR 329 Ca 0.22 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1xck s THR 329 Cb 0.25 -0.66 -0.00 0.00 0.01 0.00 0.00 72.50 72.09 1xck s THR 329 CO -0.11 0.04 -0.15 -0.89 -0.69 0.00 0.00 174.62 172.83 1xck s THR 330 N 1.68 2.74 -0.12 -0.82 2.01 -0.36 0.10 115.64 120.87 1xck s THR 330 Ca -0.08 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.17 1xck s THR 330 Cb -0.09 -2.16 0.03 0.00 0.01 0.00 0.00 72.50 70.29 1xck s THR 330 CO -0.13 0.51 -0.05 0.28 -0.69 0.00 0.00 174.62 174.54 1xck s THR 331 N 0.76 0.90 -0.26 -0.82 -1.32 0.00 -1.22 115.64 113.69 1xck s THR 331 Ca -0.06 -0.29 -0.18 0.00 -1.21 0.00 0.00 61.69 59.95 1xck s THR 331 Cb -0.15 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.81 1xck s THR 331 CO 0.01 0.27 0.53 -0.63 -2.21 0.00 0.00 174.62 172.59 1xck s ILE 332 N 1.75 5.06 -0.23 5.08 1.01 0.57 -1.43 121.20 133.01 1xck s ILE 332 Ca 0.04 0.92 -0.06 0.00 0.00 0.00 0.00 60.65 61.55 1xck s ILE 332 Cb -0.13 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1xck s ILE 332 CO -0.08 0.08 0.02 -0.63 0.00 0.00 0.00 174.94 174.34 1xck s ILE 333 N 2.30 3.94 -0.37 2.92 1.01 0.13 -1.80 121.20 129.34 1xck s ILE 333 Ca 0.22 -0.30 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 1xck s ILE 333 Cb -0.16 -2.81 0.01 0.00 0.01 0.00 0.00 42.46 39.51 1xck s ILE 333 CO 0.09 0.39 0.32 -0.67 0.00 0.00 0.00 174.94 175.07 1xck n ASP 334 N 4.69 -7.90 -4.85 3.58 2.03 0.23 -2.29 116.55 112.03 1xck n ASP 334 Ca -0.17 0.92 -0.33 0.00 0.52 0.00 0.00 54.79 55.73 1xck n ASP 334 Cb 0.51 -5.18 -0.06 0.00 -0.72 0.00 0.00 41.12 35.68 1xck n ASP 334 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1xck s GLY 335 N -2.10 2.37 0.00 0.27 0.00 -0.99 -0.70 107.32 106.17 1xck s GLY 335 Ca 0.14 -0.10 0.16 0.00 0.00 0.00 0.00 44.72 44.92 1xck s GLY 335 CO 0.76 0.11 1.38 -0.62 0.00 0.00 0.00 173.10 174.73 1xck n VAL 336 N 0.08 0.00 -1.59 1.40 0.31 0.79 -4.84 118.33 114.48 1xck n VAL 336 Ca -0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 63.89 1xck n VAL 336 Cb 0.52 -0.65 -0.01 0.00 -0.91 0.00 0.00 33.84 32.79 1xck n VAL 336 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xck n GLY 337 N 0.14 -0.30 3.72 2.92 0.00 -0.54 -4.72 105.19 106.40 1xck n GLY 337 Ca 0.12 0.28 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 1xck n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xck s GLU 338 N -1.65 4.50 0.49 1.61 0.41 -1.26 -4.89 118.70 117.91 1xck s GLU 338 Ca 0.59 1.68 0.29 0.00 -0.41 0.00 0.00 54.97 57.12 1xck s GLU 338 Cb -0.67 -3.36 1.38 0.00 -1.78 0.00 0.00 34.13 29.71 1xck s GLU 338 CO 0.59 -0.13 1.82 0.93 -0.49 0.00 0.00 175.26 177.98 1xck h GLU 339 N 6.42 0.13 0.58 1.61 4.39 -1.96 0.14 114.58 125.89 1xck h GLU 339 Ca -0.42 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.24 1xck h GLU 339 Cb 1.21 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.84 1xck h GLU 339 CO 0.78 0.09 -0.28 0.00 -1.16 0.00 0.00 179.01 178.44 1xck h ALA 340 N 1.51 -0.78 -0.15 3.43 0.00 -1.98 -1.27 119.26 120.03 1xck h ALA 340 Ca 0.54 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.31 1xck h ALA 340 Cb 1.86 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 19.89 1xck h ALA 340 CO -0.10 -0.74 -0.36 0.00 0.00 0.00 0.00 179.25 178.05 1xck h ALA 341 N -1.09 -0.43 0.47 0.00 0.00 -1.31 0.94 119.26 117.83 1xck h ALA 341 Ca -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 341 Cb 0.62 0.68 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1xck h ALA 341 CO 0.13 -0.84 -0.49 0.82 0.00 0.00 0.00 179.25 178.87 1xck h ILE 342 N -0.42 0.04 -0.05 0.00 2.04 -0.93 -0.89 117.51 117.30 1xck h ILE 342 Ca 0.09 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1xck h ILE 342 Cb 0.58 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1xck h ILE 342 CO -0.38 0.00 0.10 -0.61 0.00 0.00 0.00 178.15 177.26 1xck h GLN 343 N -0.97 0.00 0.08 2.37 5.75 -1.03 0.48 115.11 121.78 1xck h GLN 343 Ca -0.06 0.00 -0.26 0.00 -0.15 0.00 0.00 58.65 58.19 1xck h GLN 343 Cb 0.85 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.41 1xck h GLN 343 CO -0.07 0.00 -1.12 0.78 -2.65 0.00 0.00 178.83 175.77 1xck h GLY 344 N 0.00 0.46 1.06 2.39 0.00 -0.03 -2.95 103.07 104.00 1xck h GLY 344 Ca 0.02 -0.95 -0.10 0.00 0.00 0.00 0.00 47.33 46.31 1xck h GLY 344 CO -0.00 0.83 -0.05 -0.09 0.00 0.00 0.00 176.54 177.24 1xck h ARG 345 N 0.18 0.97 -0.65 4.80 9.65 0.42 -2.17 114.38 127.58 1xck h ARG 345 Ca -0.12 -0.33 0.09 0.00 -1.10 0.00 0.00 59.98 58.51 1xck h ARG 345 Cb 1.79 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 30.26 1xck h ARG 345 CO 0.19 1.01 0.43 0.28 2.80 0.00 0.00 179.97 184.68 1xck h VAL 346 N 0.85 0.94 0.66 0.20 2.07 -1.30 -1.89 116.25 117.78 1xck h VAL 346 Ca 0.15 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 1xck h VAL 346 Cb 0.60 0.34 0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1xck h VAL 346 CO 0.04 0.10 -0.32 0.00 0.02 0.00 0.00 177.57 177.41 1xck h ALA 347 N 1.66 -0.89 -0.20 1.67 0.00 -1.22 0.98 119.26 121.26 1xck h ALA 347 Ca 0.30 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1xck h ALA 347 Cb 0.45 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 1xck h ALA 347 CO -0.09 -0.90 -0.47 1.96 0.00 0.00 0.00 179.25 179.74 1xck h GLN 348 N -1.08 -0.47 -0.95 0.00 4.20 -1.08 0.20 115.11 115.93 1xck h GLN 348 Ca -0.09 0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.76 1xck h GLN 348 Cb 0.72 0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.53 1xck h GLN 348 CO 0.15 -0.31 0.61 0.82 -0.67 0.00 0.00 178.83 179.42 1xck h ILE 349 N -0.49 0.94 0.00 2.54 2.04 -1.37 0.33 117.51 121.50 1xck h ILE 349 Ca 0.07 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1xck h ILE 349 Cb 0.64 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1xck h ILE 349 CO -0.46 0.17 0.00 -0.09 0.00 0.00 0.00 178.15 177.77 1xck h ARG 350 N 0.93 0.00 0.18 2.37 2.43 0.75 -2.53 114.38 118.50 1xck h ARG 350 Ca 0.46 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 59.29 1xck h ARG 350 Cb 0.47 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1xck h ARG 350 CO -0.22 0.00 -1.65 1.96 -1.51 0.00 0.00 179.97 178.55 1xck h GLN 351 N 0.00 0.37 -0.90 0.20 1.08 0.25 -3.31 115.11 112.80 1xck h GLN 351 Ca 0.00 -0.64 0.07 0.00 -1.45 0.00 0.00 58.65 56.64 1xck h GLN 351 Cb 0.53 0.24 -0.06 0.00 -0.05 0.00 0.00 27.48 28.14 1xck h GLN 351 CO 0.00 1.28 0.59 1.96 -0.95 0.00 0.00 178.83 181.70 1xck h GLN 352 N 0.10 0.96 -0.27 1.46 1.08 -0.46 -0.46 115.11 117.52 1xck h GLN 352 Ca -0.30 -0.06 0.08 0.00 -1.45 0.00 0.00 58.65 56.92 1xck h GLN 352 Cb 2.09 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 29.29 1xck h GLN 352 CO 0.19 0.63 0.19 0.82 -0.95 0.00 0.00 178.83 179.72 1xck h ILE 353 N 0.99 0.86 0.12 2.54 2.04 -1.56 -0.97 117.51 121.53 1xck h ILE 353 Ca 0.40 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.25 1xck h ILE 353 Cb 0.26 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1xck h ILE 353 CO -0.16 0.00 -0.06 -0.33 0.00 0.00 0.00 178.15 177.61 1xck h GLU 354 N 0.00 -0.15 -0.04 2.37 4.39 -1.22 -3.20 114.58 116.72 1xck h GLU 354 Ca 0.13 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1xck h GLU 354 Cb 0.51 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1xck h GLU 354 CO -0.00 0.28 0.00 0.39 -1.16 0.00 0.00 179.01 178.52 1xck n GLU 355 N -4.85 0.46 -2.42 2.33 1.02 -0.95 -4.74 120.64 111.49 1xck n GLU 355 Ca -0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.65 1xck n GLU 355 Cb 0.25 -1.02 -0.02 0.00 -0.02 0.00 0.00 31.44 30.63 1xck n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xck s ALA 356 N -1.92 3.59 -2.03 0.62 0.00 -0.41 -4.89 121.76 116.71 1xck s ALA 356 Ca 0.00 0.37 0.27 0.00 0.00 0.00 0.00 51.96 52.60 1xck s ALA 356 Cb 0.00 -3.66 0.87 0.00 0.00 0.00 0.00 23.12 20.33 1xck s ALA 356 CO 0.00 -1.32 1.63 0.25 0.00 0.00 0.00 175.76 176.32 1xck n THR 357 N 5.58 0.00 -4.14 0.00 -2.24 -1.26 -4.92 114.28 107.30 1xck n THR 357 Ca 0.14 -0.17 -0.10 0.00 -2.27 0.00 0.00 64.05 61.65 1xck n THR 357 Cb 0.45 0.43 -0.10 0.00 -2.10 0.00 0.00 70.33 69.02 1xck n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xck s SER 358 N -2.32 0.26 -0.08 3.42 0.15 -1.26 -5.08 113.70 108.79 1xck s SER 358 Ca 0.29 -1.22 -0.18 0.00 0.70 0.00 0.00 55.95 55.55 1xck s SER 358 Cb 0.20 0.32 -0.14 0.00 -1.71 0.00 0.00 66.02 64.69 1xck s SER 358 CO 0.45 -0.77 0.67 0.44 1.20 0.00 0.00 173.24 175.23 1xck h ASP 359 N 2.79 -0.13 -0.70 5.45 3.32 -1.99 -3.04 116.42 122.12 1xck h ASP 359 Ca -0.35 -0.38 0.15 0.00 0.02 0.00 0.00 57.03 56.47 1xck h ASP 359 Cb 1.21 0.03 -0.12 0.00 0.22 0.00 0.00 39.33 40.67 1xck h ASP 359 CO 0.57 0.49 -0.04 0.22 -1.72 0.00 0.00 179.24 178.76 1xck h TYR 360 N -0.93 -0.13 0.00 4.55 3.20 -1.99 0.70 116.97 122.37 1xck h TYR 360 Ca -0.02 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1xck h TYR 360 Cb 0.51 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 1xck h TYR 360 CO 0.10 -0.24 -0.11 -0.44 -1.64 0.00 0.00 178.16 175.83 1xck h ASP 361 N 0.08 0.00 0.01 -2.11 5.19 -2.00 -1.73 116.42 115.86 1xck h ASP 361 Ca 0.37 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.68 1xck h ASP 361 Cb 0.61 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.13 1xck h ASP 361 CO -0.64 0.11 -0.40 -0.09 -3.12 0.00 0.00 179.24 175.11 1xck h ARG 362 N 0.00 0.26 -0.13 3.56 2.43 0.31 -2.90 114.38 117.92 1xck h ARG 362 Ca -0.00 -0.29 0.04 0.00 -0.81 0.00 0.00 59.98 58.93 1xck h ARG 362 Cb 0.21 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 1xck h ARG 362 CO 0.01 1.01 -0.20 0.93 -1.51 0.00 0.00 179.97 180.21 1xck h GLU 363 N -0.37 -0.25 -0.70 0.20 4.39 0.05 -0.61 114.58 117.29 1xck h GLU 363 Ca -0.05 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.70 1xck h GLU 363 Cb 1.15 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.82 1xck h GLU 363 CO 0.08 -0.17 0.46 0.87 -1.16 0.00 0.00 179.01 179.09 1xck h LYS 364 N -0.26 0.81 -0.22 2.33 1.79 -1.43 -1.15 116.57 118.44 1xck h LYS 364 Ca 0.10 -0.05 -0.12 0.00 -2.18 0.00 0.00 60.65 58.40 1xck h LYS 364 Cb 0.40 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1xck h LYS 364 CO -0.28 0.54 -0.34 -0.07 -1.08 0.00 0.00 179.45 178.22 1xck h LEU 365 N 0.84 0.68 -1.44 2.94 3.38 -1.18 -2.79 115.31 117.74 1xck h LEU 365 Ca 0.28 -0.52 0.04 0.00 0.09 0.00 0.00 57.88 57.77 1xck h LEU 365 Cb 0.07 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1xck h LEU 365 CO -0.08 1.07 0.42 1.56 0.09 0.00 0.00 178.44 181.50 1xck h GLN 366 N 0.31 0.69 -0.00 1.13 1.08 -0.54 -1.71 115.11 116.07 1xck h GLN 366 Ca 0.02 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1xck h GLN 366 Cb 0.92 -0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 28.20 1xck h GLN 366 CO 0.08 0.46 0.00 0.93 -0.95 0.00 0.00 178.83 179.35 1xck h GLU 367 N 0.72 0.01 -0.66 1.46 5.08 -1.05 -1.26 114.58 118.87 1xck h GLU 367 Ca 0.26 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1xck h GLU 367 Cb 0.14 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1xck h GLU 367 CO -0.08 0.01 0.40 0.00 -1.00 0.00 0.00 179.01 178.35 1xck h ARG 368 N 0.00 0.89 -0.51 2.33 3.08 -1.06 -1.49 114.38 117.63 1xck h ARG 368 Ca 0.00 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 1xck h ARG 368 Cb 0.00 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1xck h ARG 368 CO -0.00 0.63 -0.10 -0.39 -1.07 0.00 0.00 179.97 179.04 1xck h VAL 369 N 0.90 1.26 -0.59 2.04 -1.51 -1.36 -1.66 116.25 115.33 1xck h VAL 369 Ca 0.24 -1.22 0.10 0.00 -1.23 0.00 0.00 66.70 64.58 1xck h VAL 369 Cb -0.04 0.98 -0.07 0.00 -2.13 0.00 0.00 31.29 30.03 1xck h VAL 369 CO -0.05 0.43 0.19 0.00 -1.23 0.00 0.00 177.57 176.91 1xck h ALA 370 N 1.04 0.74 0.75 5.19 0.00 -0.64 0.52 119.26 126.86 1xck h ALA 370 Ca 0.14 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1xck h ALA 370 Cb 0.63 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1xck h ALA 370 CO 0.04 -0.24 -0.36 0.87 0.00 0.00 0.00 179.25 179.56 1xck h LYS 371 N 0.35 -0.98 0.09 0.00 1.57 -1.00 0.28 116.57 116.89 1xck h LYS 371 Ca 0.30 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1xck h LYS 371 Cb 0.40 0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1xck h LYS 371 CO -0.33 -0.65 -0.17 1.25 -0.57 0.00 0.00 179.45 178.98 1xck h LEU 372 N -1.21 -0.49 -1.64 2.94 5.85 -0.95 -2.94 115.31 116.87 1xck h LEU 372 Ca -0.10 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1xck h LEU 372 Cb 0.78 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1xck h LEU 372 CO 0.17 -0.20 0.07 0.00 -0.34 0.00 0.00 178.44 178.14 1xck h ALA 373 N -1.34 1.72 -0.90 1.25 0.00 -0.10 -3.17 119.26 116.72 1xck h ALA 373 Ca -0.01 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xck h ALA 373 Cb 0.26 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1xck h ALA 373 CO -0.06 0.23 0.60 0.78 0.00 0.00 0.00 179.25 180.79 1xck h GLY 374 N 0.46 1.27 0.00 0.00 0.00 -0.77 -3.49 103.07 100.55 1xck h GLY 374 Ca 0.08 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1xck h GLY 374 CO -0.01 0.45 0.00 0.61 0.00 0.00 0.00 176.54 177.60 1xck n GLY 375 N -1.35 -1.22 3.08 4.60 0.00 -1.13 -4.90 105.19 104.28 1xck n GLY 375 Ca 0.10 -1.26 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 1xck n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xck s VAL 376 N 0.00 -0.22 0.20 1.61 1.01 -0.17 -4.54 120.40 118.29 1xck s VAL 376 Ca 0.00 0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 1xck s VAL 376 Cb 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 36.38 35.84 1xck s VAL 376 CO 0.00 0.08 0.89 0.00 0.00 0.00 0.00 175.10 176.07 1xck s ALA 377 N 1.80 3.36 -0.20 5.51 0.00 0.07 -0.23 121.76 132.08 1xck s ALA 377 Ca -0.05 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.44 1xck s ALA 377 Cb -0.11 -3.14 0.04 0.00 0.00 0.00 0.00 23.12 19.92 1xck s ALA 377 CO -0.09 0.20 -0.09 0.08 0.00 0.00 0.00 175.76 175.86 1xck s VAL 378 N -1.00 1.53 -0.36 0.00 1.01 -0.65 -0.75 120.40 120.18 1xck s VAL 378 Ca 0.40 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 1xck s VAL 378 Cb -0.25 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 1xck s VAL 378 CO 0.30 0.13 0.28 -0.63 0.00 0.00 0.00 175.10 175.18 1xck s ILE 379 N 1.44 5.25 -0.34 2.22 1.01 0.08 -2.65 121.20 128.21 1xck s ILE 379 Ca -0.01 -0.29 -0.13 0.00 0.00 0.00 0.00 60.65 60.22 1xck s ILE 379 Cb -0.16 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.49 1xck s ILE 379 CO -0.08 -0.12 0.23 -0.54 0.00 0.00 0.00 174.94 174.44 1xck s LYS 380 N 1.78 3.47 -0.14 2.79 1.02 0.19 -0.69 119.74 128.17 1xck s LYS 380 Ca 0.07 -0.66 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 1xck s LYS 380 Cb -0.18 -3.79 -0.01 0.00 -0.52 0.00 0.00 37.83 33.34 1xck s LYS 380 CO 0.11 -0.45 1.01 0.08 -0.92 0.00 0.00 175.35 175.18 1xck s VAL 381 N 1.71 4.76 0.19 3.17 1.01 -0.82 -1.27 120.40 129.16 1xck s VAL 381 Ca 0.06 2.04 0.02 0.00 0.00 0.00 0.00 61.98 64.09 1xck s VAL 381 Cb -0.17 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 1xck s VAL 381 CO 0.10 -0.04 0.35 -0.83 0.00 0.00 0.00 175.10 174.67 1xck s GLY 382 N 1.13 1.64 0.15 4.51 0.00 -1.26 -1.30 107.32 112.19 1xck s GLY 382 Ca 0.47 -0.99 -0.25 0.00 0.00 0.00 0.00 44.72 43.95 1xck s GLY 382 CO 0.15 -0.97 0.94 0.00 0.00 0.00 0.00 173.10 173.22 1xck s ALA 383 N -1.85 -1.65 0.11 3.20 0.00 -1.07 -4.51 121.76 115.99 1xck s ALA 383 Ca 0.36 0.17 -0.04 0.00 0.00 0.00 0.00 51.96 52.45 1xck s ALA 383 Cb -0.11 0.64 -0.17 0.00 0.00 0.00 0.00 23.12 23.48 1xck s ALA 383 CO 0.29 -1.02 1.23 0.00 0.00 0.00 0.00 175.76 176.27 1xck h ALA 384 N 2.00 0.25 -2.35 0.00 0.00 -1.95 -3.09 119.26 114.12 1xck h ALA 384 Ca -0.24 -0.78 -0.40 0.00 0.00 0.00 0.00 54.91 53.49 1xck h ALA 384 Cb 1.23 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 1xck h ALA 384 CO 0.26 0.88 -0.73 0.95 0.00 0.00 0.00 179.25 180.61 1xck s THR 385 N -3.00 1.44 0.29 0.00 -4.23 -1.26 -4.94 115.64 103.94 1xck s THR 385 Ca -0.05 -2.06 -0.02 0.00 -1.18 0.00 0.00 61.69 58.38 1xck s THR 385 Cb 0.08 -1.87 0.24 0.00 1.34 0.00 0.00 72.50 72.29 1xck s THR 385 CO 0.87 -0.62 1.94 -0.08 -0.54 0.00 0.00 174.62 176.19 1xck h GLU 386 N 2.83 1.06 0.41 3.99 4.81 -1.99 -0.81 114.58 124.88 1xck h GLU 386 Ca -0.38 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 1xck h GLU 386 Cb 1.20 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1xck h GLU 386 CO 0.60 0.74 -0.22 0.28 -0.73 0.00 0.00 179.01 179.68 1xck h VAL 387 N 1.08 0.55 -0.67 0.32 2.07 -1.99 0.06 116.25 117.67 1xck h VAL 387 Ca 0.28 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.82 1xck h VAL 387 Cb -0.06 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1xck h VAL 387 CO -0.05 0.00 0.44 -0.33 0.02 0.00 0.00 177.57 177.64 1xck h GLU 388 N -0.58 0.86 0.27 1.57 5.08 -1.92 -1.43 114.58 118.42 1xck h GLU 388 Ca -0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1xck h GLU 388 Cb 0.46 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1xck h GLU 388 CO 0.08 0.57 -0.28 1.98 -1.00 0.00 0.00 179.01 180.35 1xck h MET 389 N 0.89 -0.57 -0.61 2.33 4.05 -0.92 0.11 114.93 120.21 1xck h MET 389 Ca 0.25 0.04 0.04 0.00 -0.28 0.00 0.00 59.70 59.75 1xck h MET 389 Cb -0.07 0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 1xck h MET 389 CO -0.07 -0.38 0.41 0.87 0.23 0.00 0.00 176.91 177.97 1xck h LYS 390 N -0.59 0.66 0.23 0.39 1.79 -0.84 0.10 116.57 118.32 1xck h LYS 390 Ca -0.01 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1xck h LYS 390 Cb 0.55 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1xck h LYS 390 CO -0.07 0.44 -0.11 1.49 -1.08 0.00 0.00 179.45 180.12 1xck h GLU 391 N 0.68 -0.30 -0.43 3.15 4.22 -0.63 -2.75 114.58 118.53 1xck h GLU 391 Ca 0.25 0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.71 1xck h GLU 391 Cb 0.15 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1xck h GLU 391 CO -0.07 0.03 0.26 -0.22 -2.18 0.00 0.00 179.01 176.82 1xck h LYS 392 N -0.65 0.57 -0.70 1.92 3.64 -0.50 -1.51 116.57 119.34 1xck h LYS 392 Ca -0.03 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1xck h LYS 392 Cb 0.46 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 1xck h LYS 392 CO 0.05 0.40 0.43 -0.22 -2.27 0.00 0.00 179.45 177.84 1xck h LYS 393 N 0.58 0.81 -0.29 1.90 3.64 -0.90 0.17 116.57 122.48 1xck h LYS 393 Ca 0.15 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1xck h LYS 393 Cb -0.03 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1xck h LYS 393 CO -0.03 0.54 0.10 0.00 -2.27 0.00 0.00 179.45 177.79 1xck h ALA 394 N 1.31 0.38 -0.21 5.00 0.00 -0.99 -0.32 119.26 124.44 1xck h ALA 394 Ca 0.29 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 394 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xck h ALA 394 CO -0.12 0.01 -0.08 0.00 0.00 0.00 0.00 179.25 179.06 1xck h ARG 395 N 0.32 0.32 -0.13 0.00 3.08 -0.84 -1.26 114.38 115.87 1xck h ARG 395 Ca 0.10 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1xck h ARG 395 Cb 0.23 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 1xck h ARG 395 CO -0.00 0.42 -0.08 0.28 -1.07 0.00 0.00 179.97 179.51 1xck h VAL 396 N 0.31 1.33 -0.86 2.04 2.07 -0.35 -0.75 116.25 120.04 1xck h VAL 396 Ca 0.07 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.50 1xck h VAL 396 Cb 0.34 1.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 1xck h VAL 396 CO 0.02 0.33 0.53 -0.33 0.02 0.00 0.00 177.57 178.14 1xck h GLU 397 N -0.06 0.92 0.42 1.57 5.08 -0.68 0.57 114.58 122.40 1xck h GLU 397 Ca 0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1xck h GLU 397 Cb 0.56 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xck h GLU 397 CO 0.02 0.61 -0.20 -0.44 -1.00 0.00 0.00 179.01 178.00 1xck h ASP 398 N 0.94 -0.48 -0.60 1.42 3.32 -1.18 -2.87 116.42 116.99 1xck h ASP 398 Ca 0.38 -0.10 0.17 0.00 0.02 0.00 0.00 57.03 57.50 1xck h ASP 398 Cb 0.21 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1xck h ASP 398 CO -0.19 -0.08 0.51 0.00 -1.72 0.00 0.00 179.24 177.76 1xck h ALA 399 N -0.69 2.44 0.14 3.45 0.00 -0.95 -0.74 119.26 122.90 1xck h ALA 399 Ca -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1xck h ALA 399 Cb 0.56 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xck h ALA 399 CO 0.10 -0.81 -0.07 1.25 0.00 0.00 0.00 179.25 179.72 1xck h LEU 400 N 0.00 -0.16 -0.68 0.00 5.85 -0.74 -1.30 115.31 118.29 1xck h LEU 400 Ca 0.28 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1xck h LEU 400 Cb 1.29 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.32 1xck h LEU 400 CO -0.00 0.25 0.42 0.45 -0.34 0.00 0.00 178.44 179.21 1xck h HIS 401 N -0.58 0.79 0.20 1.25 3.86 -0.95 0.85 115.15 120.56 1xck h HIS 401 Ca -0.02 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1xck h HIS 401 Cb 0.45 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 1xck h HIS 401 CO 0.05 0.45 -0.23 0.00 0.86 0.00 0.00 177.93 179.06 1xck h ALA 402 N 1.29 -0.45 -0.96 2.45 0.00 -1.28 -1.53 119.26 118.77 1xck h ALA 402 Ca 0.27 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xck h ALA 402 Cb 0.02 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1xck h ALA 402 CO -0.11 -0.79 0.59 1.15 0.00 0.00 0.00 179.25 180.10 1xck h THR 403 N -0.48 1.26 -0.33 0.00 2.02 -0.92 0.45 112.91 114.91 1xck h THR 403 Ca 0.00 -0.55 0.05 0.00 0.77 0.00 0.00 66.41 66.69 1xck h THR 403 Cb 0.46 -0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.71 1xck h THR 403 CO -0.07 0.27 0.04 -0.09 0.37 0.00 0.00 175.52 176.04 1xck h ARG 404 N 1.33 0.14 -0.27 6.66 1.12 -0.52 0.95 114.38 123.78 1xck h ARG 404 Ca 0.35 -0.01 -0.12 0.00 -1.11 0.00 0.00 59.98 59.09 1xck h ARG 404 Cb -0.08 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 29.84 1xck h ARG 404 CO -0.07 0.09 -0.33 0.00 -3.11 0.00 0.00 179.97 176.56 1xck h ALA 405 N 1.26 0.92 -0.58 2.80 0.00 -0.72 -2.68 119.26 120.26 1xck h ALA 405 Ca 0.16 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1xck h ALA 405 Cb 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1xck h ALA 405 CO -0.23 0.62 0.15 0.00 0.00 0.00 0.00 179.25 179.79 1xck h ALA 406 N 1.15 0.77 -0.34 0.00 0.00 -0.16 -1.03 119.26 119.64 1xck h ALA 406 Ca 0.06 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1xck h ALA 406 Cb 0.81 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1xck h ALA 406 CO 0.07 0.46 0.06 0.28 0.00 0.00 0.00 179.25 180.12 1xck h VAL 407 N 0.84 1.17 -0.09 0.00 2.07 -0.69 0.90 116.25 120.45 1xck h VAL 407 Ca 0.18 -0.63 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 1xck h VAL 407 Cb 0.33 0.85 0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1xck h VAL 407 CO -0.00 0.22 -0.43 -0.33 0.02 0.00 0.00 177.57 177.05 1xck h GLU 408 N 0.50 0.46 0.00 1.57 5.08 -1.10 -3.41 114.58 117.67 1xck h GLU 408 Ca 0.11 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1xck h GLU 408 Cb 0.23 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1xck h GLU 408 CO -0.00 1.00 -0.00 0.39 -1.00 0.00 0.00 179.01 179.40 1xck n GLU 409 N -4.30 0.72 0.00 2.33 1.02 -0.43 -5.09 120.64 114.88 1xck n GLU 409 Ca -0.08 -0.74 0.00 0.00 -0.02 0.00 0.00 57.16 56.32 1xck n GLU 409 Cb 0.56 -0.62 0.00 0.00 -0.02 0.00 0.00 31.44 31.36 1xck n GLU 409 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xck n GLY 410 N -0.12 -1.87 3.22 0.62 0.00 0.31 -4.45 105.19 102.89 1xck n GLY 410 Ca 0.00 -1.40 -0.15 0.00 0.00 0.00 0.00 46.02 44.47 1xck n GLY 410 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xck s VAL 411 N 0.00 1.10 0.21 1.61 -7.23 -0.28 -0.67 120.40 115.14 1xck s VAL 411 Ca 0.00 -1.84 -0.01 0.00 -1.81 0.00 0.00 61.98 58.32 1xck s VAL 411 Cb 0.00 -1.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1xck s VAL 411 CO 0.00 -0.63 0.12 0.68 -0.31 0.00 0.00 175.10 174.97 1xck s VAL 412 N -2.81 0.07 0.27 1.32 -7.23 -0.63 -1.16 120.40 110.24 1xck s VAL 412 Ca 0.11 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.98 1xck s VAL 412 Cb -0.01 -2.51 -0.12 0.00 0.56 0.00 0.00 36.38 34.30 1xck s VAL 412 CO 0.01 -0.01 1.55 0.00 -0.31 0.00 0.00 175.10 176.33 1xck n ALA 413 N -0.29 2.12 -1.53 1.32 0.00 -1.26 -1.61 120.51 119.25 1xck n ALA 413 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1xck n ALA 413 Cb 0.66 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.70 1xck n ALA 413 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xck n GLY 414 N 2.28 0.94 2.68 0.00 0.00 0.26 -3.02 105.19 108.33 1xck n GLY 414 Ca 0.10 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.18 1xck n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 415 N 5.00 1.40 2.44 -0.02 0.00 -1.26 -1.86 105.19 110.90 1xck n GLY 415 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1xck n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xck n GLY 416 N -0.17 0.47 0.14 -0.02 0.00 -1.26 -4.41 105.19 99.94 1xck n GLY 416 Ca -0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.90 1xck n GLY 416 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1xck h VAL 417 N 0.00 0.77 -0.19 1.61 -1.51 -1.57 -3.21 116.25 112.15 1xck h VAL 417 Ca 0.00 -2.11 -0.00 0.00 -1.23 0.00 0.00 66.70 63.36 1xck h VAL 417 Cb 0.17 2.35 -0.01 0.00 -2.13 0.00 0.00 31.29 31.67 1xck h VAL 417 CO 0.00 0.44 0.12 0.00 -1.23 0.00 0.00 177.57 176.90 1xck h ALA 418 N 1.53 0.24 -0.84 5.19 0.00 -1.72 0.81 119.26 124.46 1xck h ALA 418 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xck h ALA 418 Cb 1.38 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 1xck h ALA 418 CO 0.06 -0.26 0.47 -0.07 0.00 0.00 0.00 179.25 179.44 1xck h LEU 419 N 0.24 1.05 -0.82 0.00 3.38 -1.85 -0.32 115.31 116.99 1xck h LEU 419 Ca 0.07 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1xck h LEU 419 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1xck h LEU 419 CO -0.01 0.84 -0.35 -0.29 0.09 0.00 0.00 178.44 178.71 1xck h ILE 420 N 1.17 1.29 0.13 1.22 2.10 -1.49 -1.42 117.51 120.51 1xck h ILE 420 Ca 0.30 -1.46 -0.01 0.00 1.08 0.00 0.00 64.86 64.77 1xck h ILE 420 Cb 0.02 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 1xck h ILE 420 CO -0.05 0.46 -0.06 -0.09 -1.08 0.00 0.00 178.15 177.33 1xck h ARG 421 N 0.40 -0.17 -0.97 2.19 9.65 -0.35 -1.27 114.38 123.86 1xck h ARG 421 Ca 0.04 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.00 1xck h ARG 421 Cb 0.81 0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 29.36 1xck h ARG 421 CO 0.07 0.06 0.63 0.28 2.80 0.00 0.00 179.97 183.81 1xck h VAL 422 N -0.38 1.08 -0.38 0.20 2.07 -0.98 -2.34 116.25 115.53 1xck h VAL 422 Ca -0.02 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.02 1xck h VAL 422 Cb 0.31 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 1xck h VAL 422 CO 0.03 0.21 -0.12 0.00 0.02 0.00 0.00 177.57 177.70 1xck h ALA 423 N 1.47 0.52 -0.04 1.67 0.00 -1.02 -2.72 119.26 119.14 1xck h ALA 423 Ca 0.42 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 423 Cb 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xck h ALA 423 CO -0.16 0.41 0.05 0.66 0.00 0.00 0.00 179.25 180.21 1xck h SER 424 N 0.54 0.00 1.47 0.00 4.64 -0.70 -0.59 113.55 118.91 1xck h SER 424 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1xck h SER 424 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1xck h SER 424 CO 0.04 0.00 -0.14 0.11 -0.87 0.00 0.00 176.83 175.97 1xck h LYS 425 N 0.00 0.00 -0.62 4.77 1.57 -1.20 -3.31 116.57 117.79 1xck h LYS 425 Ca 0.02 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1xck h LYS 425 Cb 0.13 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1xck h LYS 425 CO -0.00 0.00 0.07 1.28 -0.57 0.00 0.00 179.45 180.23 1xck n LEU 426 N -2.43 5.86 -0.22 2.94 4.77 -0.23 -4.63 117.00 123.07 1xck n LEU 426 Ca 0.05 -3.01 0.14 0.00 -0.03 0.00 0.00 56.01 53.16 1xck n LEU 426 Cb 0.46 -0.70 0.45 0.00 -2.33 0.00 0.00 43.42 41.29 1xck n LEU 426 CO 0.32 0.67 1.22 0.00 -1.33 0.00 0.00 177.39 178.27 1xck h ALA 427 N 3.70 2.00 -0.35 -1.18 0.00 -1.65 -1.39 119.26 120.39 1xck h ALA 427 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xck h ALA 427 Cb 2.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1xck h ALA 427 CO 0.56 -0.23 0.00 -0.25 0.00 0.00 0.00 179.25 179.33 1xck n ASP 428 N -4.52 2.40 -4.72 0.00 8.00 -1.26 -4.92 116.55 111.53 1xck n ASP 428 Ca 0.16 -1.89 -0.42 0.00 0.71 0.00 0.00 54.79 53.35 1xck n ASP 428 Cb 0.52 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 1xck n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xck s LEU 429 N -1.30 4.37 0.18 0.64 2.96 -0.53 -5.01 118.68 119.99 1xck s LEU 429 Ca 0.33 2.46 0.03 0.00 -0.22 0.00 0.00 54.13 56.73 1xck s LEU 429 Cb 0.18 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 1xck s LEU 429 CO 0.25 -0.73 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.38 1xck s ARG 430 N 1.10 1.14 0.00 1.98 1.81 -1.26 -4.95 118.95 118.77 1xck s ARG 430 Ca 0.67 -1.53 0.00 0.00 -1.72 0.00 0.00 55.73 53.14 1xck s ARG 430 Cb -0.40 -0.50 0.00 0.00 -0.45 0.00 0.00 34.95 33.60 1xck s ARG 430 CO 0.31 -0.04 0.00 0.41 -0.68 0.00 0.00 175.30 175.30 1xck n GLY 431 N -0.27 5.72 0.16 -3.53 0.00 -1.26 -5.00 105.19 101.01 1xck n GLY 431 Ca -0.08 -2.07 0.04 0.00 0.00 0.00 0.00 46.02 43.91 1xck n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xck h GLN 432 N 0.00 0.00 -4.03 1.61 4.20 -1.99 -3.47 115.11 111.43 1xck h GLN 432 Ca 0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 1xck h GLN 432 Cb 0.00 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.69 1xck h GLN 432 CO 0.00 0.44 -0.20 0.54 -0.67 0.00 0.00 178.83 178.94 1xck s ASN 433 N -6.42 0.61 0.22 1.46 2.20 -1.26 -5.05 114.94 106.70 1xck s ASN 433 Ca 0.03 -1.35 -0.09 0.00 -0.94 0.00 0.00 52.86 50.51 1xck s ASN 433 Cb 0.09 0.63 0.17 0.00 -2.00 0.00 0.00 41.25 40.14 1xck s ASN 433 CO 0.72 -1.23 1.87 -0.08 -2.94 0.00 0.00 177.10 175.43 1xck h GLU 434 N 2.18 1.09 -0.54 3.55 4.57 -1.99 -1.76 114.58 121.69 1xck h GLU 434 Ca -0.28 -0.09 0.04 0.00 -1.18 0.00 0.00 59.36 57.84 1xck h GLU 434 Cb 1.24 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.56 1xck h GLU 434 CO 0.39 0.76 0.29 -0.44 -1.18 0.00 0.00 179.01 178.83 1xck h ASP 435 N 1.11 0.44 -0.41 1.04 3.32 -1.95 -0.49 116.42 119.47 1xck h ASP 435 Ca 0.29 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.33 1xck h ASP 435 Cb -0.06 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1xck h ASP 435 CO -0.06 0.30 0.15 1.56 -1.72 0.00 0.00 179.24 179.47 1xck h GLN 436 N 0.57 0.70 -0.78 3.56 4.20 -1.60 -0.58 115.11 121.17 1xck h GLN 436 Ca 0.23 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 1xck h GLN 436 Cb 0.11 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 1xck h GLN 436 CO -0.14 0.61 0.41 -0.91 -0.67 0.00 0.00 178.83 178.13 1xck h ASN 437 N 0.69 1.00 -0.58 1.46 2.35 -0.33 0.51 115.58 120.67 1xck h ASN 437 Ca 0.16 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 1xck h ASN 437 Cb 0.21 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1xck h ASN 437 CO -0.01 0.83 0.21 0.58 -1.65 0.00 0.00 177.43 177.39 1xck h VAL 438 N 1.09 1.23 -0.70 2.81 2.07 -0.38 -1.70 116.25 120.68 1xck h VAL 438 Ca 0.27 -0.77 0.04 0.00 0.82 0.00 0.00 66.70 67.06 1xck h VAL 438 Cb 0.07 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 1xck h VAL 438 CO -0.04 0.29 0.43 1.23 0.02 0.00 0.00 177.57 179.50 1xck h GLY 439 N 0.82 1.01 1.00 2.17 0.00 -0.27 0.15 103.07 107.95 1xck h GLY 439 Ca 0.19 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1xck h GLY 439 CO -0.01 0.25 0.34 -2.22 0.00 0.00 0.00 176.54 174.89 1xck h ILE 440 N 0.82 1.22 -0.42 2.60 2.04 -0.50 -2.08 117.51 121.18 1xck h ILE 440 Ca 0.29 -0.59 -0.09 0.00 1.00 0.00 0.00 64.86 65.47 1xck h ILE 440 Cb 0.07 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1xck h ILE 440 CO -0.13 0.25 -0.11 0.11 0.00 0.00 0.00 178.15 178.27 1xck h LYS 441 N 0.91 0.75 -0.38 2.37 1.79 -0.49 -1.17 116.57 120.36 1xck h LYS 441 Ca 0.23 -0.24 0.02 0.00 -2.18 0.00 0.00 60.65 58.47 1xck h LYS 441 Cb 0.09 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.65 1xck h LYS 441 CO -0.03 0.83 0.22 0.28 -1.08 0.00 0.00 179.45 179.67 1xck h VAL 442 N 0.68 1.03 -0.02 0.50 2.07 -0.38 -0.24 116.25 119.89 1xck h VAL 442 Ca 0.12 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1xck h VAL 442 Cb 0.57 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1xck h VAL 442 CO 0.04 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.71 1xck h ALA 443 N 1.17 0.03 -0.71 1.67 0.00 -1.11 -1.15 119.26 119.16 1xck h ALA 443 Ca 0.15 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1xck h ALA 443 Cb 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1xck h ALA 443 CO -0.07 -0.33 0.47 -0.07 0.00 0.00 0.00 179.25 179.24 1xck h LEU 444 N -0.22 0.77 -0.35 0.00 3.38 -1.10 -1.07 115.31 116.71 1xck h LEU 444 Ca 0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1xck h LEU 444 Cb 0.27 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1xck h LEU 444 CO 0.00 0.54 -0.07 -0.09 0.09 0.00 0.00 178.44 178.91 1xck h ARG 445 N 0.89 0.67 -0.40 1.13 2.43 -0.92 -2.99 114.38 115.19 1xck h ARG 445 Ca 0.28 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1xck h ARG 445 Cb 0.01 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1xck h ARG 445 CO -0.07 0.82 0.20 0.00 -1.51 0.00 0.00 179.97 179.40 1xck h ALA 446 N 0.83 1.60 0.00 2.80 0.00 -0.24 -1.77 119.26 122.47 1xck h ALA 446 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1xck h ALA 446 Cb 0.56 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1xck h ALA 446 CO 0.03 0.33 0.00 -1.33 0.00 0.00 0.00 179.25 178.28 1xck n MET 447 N -4.41 0.00 0.03 0.00 2.81 -0.50 -0.34 117.12 114.71 1xck n MET 447 Ca 0.03 0.44 0.11 0.00 -1.81 0.00 0.00 57.70 56.47 1xck n MET 447 Cb 0.11 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.19 1xck n MET 447 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1xck n GLU 448 N -1.45 0.26 -0.03 0.03 1.02 -0.67 -3.69 120.64 116.12 1xck n GLU 448 Ca 0.00 0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 57.06 1xck n GLU 448 Cb 0.01 -1.60 -0.03 0.00 -0.02 0.00 0.00 31.44 29.80 1xck n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xck h ALA 449 N 2.58 -0.21 0.13 0.62 0.00 -0.81 -2.04 119.26 119.53 1xck h ALA 449 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xck h ALA 449 Cb 0.71 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 1xck h ALA 449 CO 0.00 -0.71 -0.51 -1.35 0.00 0.00 0.00 179.25 176.68 1xck h PRO 450 N -0.29 -0.71 -0.16 0.00 0.11 -1.78 0.15 132.00 129.31 1xck h PRO 450 Ca 0.12 0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.32 1xck h PRO 450 Cb 0.48 0.16 -0.05 0.00 0.11 0.00 0.00 31.00 31.70 1xck h PRO 450 CO -0.36 -0.47 -0.13 1.25 -0.21 0.00 0.00 178.00 178.07 1xck h LEU 451 N -0.74 -0.42 -0.64 2.35 6.46 -1.71 -0.62 115.31 119.99 1xck h LEU 451 Ca -0.01 0.09 0.09 0.00 -0.12 0.00 0.00 57.88 57.93 1xck h LEU 451 Cb 0.74 0.21 -0.07 0.00 -0.73 0.00 0.00 40.66 40.81 1xck h LEU 451 CO -0.27 -0.17 0.26 0.03 -0.62 0.00 0.00 178.44 177.67 1xck h ARG 452 N -0.14 0.45 -0.28 1.25 3.08 -1.11 0.46 114.38 118.08 1xck h ARG 452 Ca 0.10 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1xck h ARG 452 Cb 0.30 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1xck h ARG 452 CO -0.25 0.30 0.15 0.37 -1.07 0.00 0.00 179.97 179.46 1xck h GLN 453 N 0.46 0.40 -0.25 0.04 5.75 -0.06 0.25 115.11 121.69 1xck h GLN 453 Ca 0.32 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.83 1xck h GLN 453 Cb 0.38 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 28.80 1xck h GLN 453 CO -0.30 0.36 -0.11 0.82 -2.65 0.00 0.00 178.83 176.96 1xck h ILE 454 N 0.33 0.65 -0.67 2.39 2.04 -0.09 0.16 117.51 122.31 1xck h ILE 454 Ca 0.10 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 1xck h ILE 454 Cb 0.08 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 1xck h ILE 454 CO -0.01 0.00 0.34 0.58 0.00 0.00 0.00 178.15 179.06 1xck h VAL 455 N -0.07 1.21 -0.50 1.67 2.07 -0.71 -2.02 116.25 117.90 1xck h VAL 455 Ca 0.13 -0.56 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 1xck h VAL 455 Cb 0.27 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1xck h VAL 455 CO -0.30 0.24 0.16 0.25 0.02 0.00 0.00 177.57 177.94 1xck h LEU 456 N 0.94 0.73 -1.82 2.57 5.85 0.29 -1.78 115.31 122.10 1xck h LEU 456 Ca 0.24 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1xck h LEU 456 Cb 0.06 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 1xck h LEU 456 CO -0.03 0.74 -0.13 0.78 -0.34 0.00 0.00 178.44 179.46 1xck h ASN 457 N 0.68 0.00 0.56 1.25 2.35 -0.28 -0.72 115.58 119.42 1xck h ASN 457 Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1xck h ASN 457 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1xck h ASN 457 CO -0.01 0.13 -0.00 0.00 -1.65 0.00 0.00 177.43 175.90 1xck n GLY 459 N 1.28 0.23 3.70 0.00 0.00 -0.28 -5.05 105.19 105.08 1xck n GLY 459 Ca 0.14 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 1xck n GLY 459 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xck s GLU 460 N -4.50 2.11 -0.50 1.61 0.41 -0.78 -5.04 118.70 112.01 1xck s GLU 460 Ca 0.03 -2.10 -0.25 0.00 -0.41 0.00 0.00 54.97 52.25 1xck s GLU 460 Cb -0.01 -1.74 0.03 0.00 -1.78 0.00 0.00 34.13 30.63 1xck s GLU 460 CO 0.04 -0.18 0.94 -1.21 -0.49 0.00 0.00 175.26 174.36 1xck s GLU 461 N -3.84 3.46 0.20 1.61 2.02 -1.26 -4.31 118.70 116.58 1xck s GLU 461 Ca 0.30 0.02 -0.12 0.00 0.02 0.00 0.00 54.97 55.19 1xck s GLU 461 Cb 0.06 -3.97 0.25 0.00 0.10 0.00 0.00 34.13 30.56 1xck s GLU 461 CO 0.16 -1.33 1.68 -1.35 0.02 0.00 0.00 175.26 174.45 1xck h PRO 462 N 9.18 0.15 -0.33 0.39 0.11 -1.87 -2.22 132.00 137.41 1xck h PRO 462 Ca -0.25 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.90 1xck h PRO 462 Cb 1.07 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1xck h PRO 462 CO 1.05 0.10 0.08 0.77 -0.21 0.00 0.00 178.00 179.79 1xck h SER 463 N 0.15 0.05 0.18 -2.05 0.02 -1.95 0.35 113.55 110.31 1xck h SER 463 Ca 0.29 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.28 1xck h SER 463 Cb 0.44 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1xck h SER 463 CO -0.44 0.06 -0.09 0.58 -1.14 0.00 0.00 176.83 175.80 1xck h VAL 464 N 0.20 0.86 -0.47 2.27 2.07 -1.86 0.40 116.25 119.72 1xck h VAL 464 Ca 0.15 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1xck h VAL 464 Cb 0.15 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1xck h VAL 464 CO -0.19 0.04 0.22 0.58 0.02 0.00 0.00 177.57 178.24 1xck h VAL 465 N -0.31 1.19 -0.60 2.57 2.07 -1.22 -0.67 116.25 119.29 1xck h VAL 465 Ca -0.02 -0.55 0.05 0.00 0.82 0.00 0.00 66.70 67.00 1xck h VAL 465 Cb 0.24 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1xck h VAL 465 CO 0.04 0.21 0.33 0.00 0.02 0.00 0.00 177.57 178.17 1xck h ALA 466 N 1.06 0.78 0.31 1.67 0.00 -0.22 -0.37 119.26 122.49 1xck h ALA 466 Ca 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1xck h ALA 466 Cb 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xck h ALA 466 CO -0.02 0.01 -0.15 -0.97 0.00 0.00 0.00 179.25 178.12 1xck h ASN 467 N 0.63 -0.35 -0.51 0.00 -1.24 -0.55 -1.44 115.58 112.12 1xck h ASN 467 Ca 0.26 0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.31 1xck h ASN 467 Cb 0.13 0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.23 1xck h ASN 467 CO -0.15 -0.24 0.29 0.74 -1.29 0.00 0.00 177.43 176.77 1xck h THR 468 N -0.43 1.02 -0.70 -3.57 2.02 -0.80 -2.06 112.91 108.39 1xck h THR 468 Ca -0.04 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1xck h THR 468 Cb 0.33 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1xck h THR 468 CO 0.07 0.10 0.38 0.58 0.37 0.00 0.00 175.52 177.02 1xck h VAL 469 N 0.57 1.22 -0.10 3.16 2.07 -0.98 -1.99 116.25 120.19 1xck h VAL 469 Ca 0.21 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1xck h VAL 469 Cb 0.06 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1xck h VAL 469 CO -0.12 0.24 -0.01 0.11 0.02 0.00 0.00 177.57 177.81 1xck h LYS 470 N 0.96 0.13 -0.19 1.57 1.57 -0.77 -2.20 116.57 117.64 1xck h LYS 470 Ca 0.25 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.94 1xck h LYS 470 Cb 0.04 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1xck h LYS 470 CO -0.04 0.16 -0.19 0.78 -0.57 0.00 0.00 179.45 179.60 1xck h GLY 471 N 0.34 0.36 0.00 3.86 0.00 -0.68 -3.45 103.07 103.50 1xck h GLY 471 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1xck h GLY 471 CO 0.00 0.23 0.00 0.61 0.00 0.00 0.00 176.54 177.39 1xck n GLY 472 N -0.64 -1.74 3.25 4.60 0.00 -0.83 -5.11 105.19 104.72 1xck n GLY 472 Ca -0.00 -1.55 -0.14 0.00 0.00 0.00 0.00 46.02 44.33 1xck n GLY 472 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xck s ASP 473 N -1.26 0.58 0.50 1.61 1.01 -1.26 -5.01 116.67 112.83 1xck s ASP 473 Ca 0.00 -1.39 0.00 0.00 0.71 0.00 0.00 52.55 51.87 1xck s ASP 473 Cb 0.00 0.30 0.00 0.00 1.01 0.00 0.00 42.92 44.23 1xck s ASP 473 CO 0.00 -0.80 0.00 0.61 0.21 0.00 0.00 175.17 175.19 1xck n GLY 474 N -0.35 2.20 1.42 0.21 0.00 -1.26 -1.31 105.19 106.09 1xck n GLY 474 Ca 0.01 -0.24 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 1xck n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xck n ASN 475 N 0.07 3.25 -4.69 1.61 4.13 -1.26 -4.88 115.26 113.49 1xck n ASN 475 Ca 0.00 -2.62 -0.42 0.00 1.68 0.00 0.00 54.58 53.22 1xck n ASN 475 Cb 0.00 -0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 37.59 1xck n ASN 475 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1xck s TYR 476 N -1.50 3.37 0.00 3.10 5.04 -0.43 -0.29 117.35 126.64 1xck s TYR 476 Ca 0.24 1.42 0.00 0.00 -2.44 0.00 0.00 57.07 56.29 1xck s TYR 476 Cb 0.20 -3.30 0.00 0.00 0.35 0.00 0.00 41.96 39.21 1xck s TYR 476 CO 0.05 -0.72 0.00 0.41 -1.34 0.00 0.00 175.55 173.95 1xck n GLY 477 N 3.22 4.15 3.22 8.97 0.00 0.81 -4.67 105.19 120.88 1xck n GLY 477 Ca 0.10 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1xck n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xck s TYR 478 N -1.49 2.85 -0.84 1.61 5.04 -1.26 -1.87 117.35 121.39 1xck s TYR 478 Ca 0.00 -1.25 -0.23 0.00 -2.44 0.00 0.00 57.07 53.14 1xck s TYR 478 Cb 0.00 -1.98 0.06 0.00 0.35 0.00 0.00 41.96 40.39 1xck s TYR 478 CO 0.00 -0.64 1.24 1.21 -1.34 0.00 0.00 175.55 176.02 1xck s ASN 479 N 1.25 6.35 0.44 4.32 3.84 0.14 -4.85 114.94 126.43 1xck s ASN 479 Ca 0.03 -1.14 0.17 0.00 0.21 0.00 0.00 52.86 52.13 1xck s ASN 479 Cb -0.14 -2.51 1.09 0.00 -0.55 0.00 0.00 41.25 39.14 1xck s ASN 479 CO -0.07 -1.53 1.94 0.00 -2.79 0.00 0.00 177.10 174.65 1xck h ALA 480 N 9.67 2.15 -0.27 1.71 0.00 -1.94 0.37 119.26 130.94 1xck h ALA 480 Ca -0.06 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1xck h ALA 480 Cb 1.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1xck h ALA 480 CO 1.28 -0.34 -0.20 0.00 0.00 0.00 0.00 179.25 179.99 1xck h ALA 481 N 1.66 1.16 -0.01 0.00 0.00 -1.95 -3.30 119.26 116.82 1xck h ALA 481 Ca 0.35 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xck h ALA 481 Cb 0.83 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1xck h ALA 481 CO -0.10 0.53 0.00 0.25 0.00 0.00 0.00 179.25 179.93 1xck n THR 482 N -4.15 0.03 -2.21 0.00 -2.24 -0.71 -4.99 114.28 100.00 1xck n THR 482 Ca -0.00 -0.51 -0.21 0.00 -2.27 0.00 0.00 64.05 61.06 1xck n THR 482 Cb 0.37 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.61 1xck n THR 482 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xck n GLU 483 N 0.14 -1.62 -4.70 -0.78 1.02 0.12 -4.98 120.64 109.84 1xck n GLU 483 Ca 0.02 1.07 -0.33 0.00 -0.02 0.00 0.00 57.16 57.89 1xck n GLU 483 Cb 0.07 -5.67 -0.12 0.00 -0.02 0.00 0.00 31.44 25.70 1xck n GLU 483 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1xck s GLU 484 N -4.75 2.91 0.17 3.49 0.41 -1.18 -4.92 118.70 114.83 1xck s GLU 484 Ca 0.00 -0.61 -0.06 0.00 -0.41 0.00 0.00 54.97 53.89 1xck s GLU 484 Cb 0.00 -2.58 -0.06 0.00 -1.78 0.00 0.00 34.13 29.71 1xck s GLU 484 CO 0.00 0.52 0.43 0.71 -0.49 0.00 0.00 175.26 176.43 1xck s TYR 485 N -0.44 3.46 -3.07 1.61 1.51 -1.26 -0.68 117.35 118.47 1xck s TYR 485 Ca 0.06 0.64 0.00 0.00 -1.01 0.00 0.00 57.07 56.76 1xck s TYR 485 Cb -0.12 -2.08 0.00 0.00 -0.11 0.00 0.00 41.96 39.65 1xck s TYR 485 CO 0.02 0.38 0.00 0.41 -1.11 0.00 0.00 175.55 175.25 1xck n GLY 486 N -0.03 -0.88 3.63 0.71 0.00 -0.78 -4.96 105.19 102.88 1xck n GLY 486 Ca -0.02 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 1xck n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xck s ASN 487 N -4.00 6.83 0.21 1.61 3.84 -1.26 -0.13 114.94 122.04 1xck s ASN 487 Ca 0.00 0.91 -0.09 0.00 0.21 0.00 0.00 52.86 53.89 1xck s ASN 487 Cb 0.00 -2.54 0.31 0.00 -0.55 0.00 0.00 41.25 38.46 1xck s ASN 487 CO 0.00 -0.99 1.73 0.24 -2.79 0.00 0.00 177.10 175.29 1xck h MET 488 N 8.48 0.36 -0.48 0.43 2.86 -0.95 -1.12 114.93 124.51 1xck h MET 488 Ca -0.22 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1xck h MET 488 Cb 1.06 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 1xck h MET 488 CO 1.06 0.24 0.27 0.82 1.06 0.00 0.00 176.91 180.35 1xck h ILE 489 N 0.37 1.17 -0.69 -1.22 1.08 -1.76 -0.29 117.51 116.17 1xck h ILE 489 Ca 0.32 -0.43 -0.03 0.00 -0.39 0.00 0.00 64.86 64.34 1xck h ILE 489 Cb 0.44 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.73 1xck h ILE 489 CO -0.35 0.18 0.32 0.44 -0.69 0.00 0.00 178.15 178.05 1xck h ASP 490 N 0.64 0.89 0.00 1.72 3.32 -1.79 -0.71 116.42 120.48 1xck h ASP 490 Ca 0.17 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1xck h ASP 490 Cb 0.05 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1xck h ASP 490 CO -0.03 0.76 0.00 0.23 -1.72 0.00 0.00 179.24 178.49 1xck n MET 491 N -4.33 0.93 -1.88 3.56 2.81 -0.48 -4.87 117.12 112.87 1xck n MET 491 Ca 0.06 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.83 1xck n MET 491 Cb 0.14 -1.18 -0.03 0.00 -0.71 0.00 0.00 33.22 31.45 1xck n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xck n GLY 492 N 0.59 0.46 3.09 3.03 0.00 -0.27 -4.98 105.19 107.10 1xck n GLY 492 Ca 0.08 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 1xck n GLY 492 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xck s ILE 493 N -2.56 3.54 0.26 -0.61 1.01 -0.17 -5.02 121.20 117.67 1xck s ILE 493 Ca 0.00 -2.78 0.02 0.00 0.00 0.00 0.00 60.65 57.89 1xck s ILE 493 Cb 0.00 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 1xck s ILE 493 CO 0.00 -0.83 0.15 -1.48 0.00 0.00 0.00 174.94 172.78 1xck s LEU 494 N 0.20 1.51 0.01 2.97 0.05 -1.26 -0.58 118.68 121.57 1xck s LEU 494 Ca 0.15 -1.49 0.00 0.00 0.05 0.00 0.00 54.13 52.84 1xck s LEU 494 Cb -0.21 0.25 -0.01 0.00 -2.05 0.00 0.00 46.19 44.17 1xck s LEU 494 CO -0.03 -0.85 -0.01 -1.81 -0.55 0.00 0.00 176.35 173.09 1xck s ASP 495 N -3.29 0.11 0.17 1.48 1.01 -0.64 -4.51 116.67 110.99 1xck s ASP 495 Ca 0.38 -0.19 -0.32 0.00 0.71 0.00 0.00 52.55 53.14 1xck s ASP 495 Cb 0.06 0.03 -0.10 0.00 1.01 0.00 0.00 42.92 43.92 1xck s ASP 495 CO 0.16 -0.11 1.63 -2.84 0.21 0.00 0.00 175.17 174.22 1xck s PRO 496 N -0.54 4.19 0.53 8.23 0.02 -1.26 -1.60 135.00 144.56 1xck s PRO 496 Ca -0.06 2.44 0.35 0.00 0.02 0.00 0.00 61.00 63.75 1xck s PRO 496 Cb -0.04 -3.19 1.51 0.00 0.02 0.00 0.00 34.50 32.81 1xck s PRO 496 CO -0.00 -0.67 1.79 1.15 -0.33 0.00 0.00 177.00 178.94 1xck h THR 497 N 4.06 0.40 -0.71 0.99 2.02 -1.11 0.19 112.91 118.75 1xck h THR 497 Ca -0.43 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 66.68 1xck h THR 497 Cb 1.20 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1xck h THR 497 CO 0.93 0.01 0.23 0.50 0.37 0.00 0.00 175.52 177.56 1xck h LYS 498 N 0.04 1.09 -0.24 6.66 3.64 -1.82 -1.34 116.57 124.60 1xck h LYS 498 Ca 0.59 -0.22 -0.10 0.00 -1.27 0.00 0.00 60.65 59.64 1xck h LYS 498 Cb 2.25 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 33.91 1xck h LYS 498 CO -0.04 0.92 -0.26 -0.39 -2.27 0.00 0.00 179.45 177.41 1xck h VAL 499 N 1.05 1.32 -0.16 2.00 -1.51 -0.93 -0.35 116.25 117.67 1xck h VAL 499 Ca 0.23 -1.43 -0.01 0.00 -1.23 0.00 0.00 66.70 64.26 1xck h VAL 499 Cb 0.28 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.13 1xck h VAL 499 CO -0.01 0.45 0.07 0.74 -1.23 0.00 0.00 177.57 177.59 1xck h THR 500 N 0.30 1.13 -0.29 7.19 2.02 -1.49 0.14 112.91 121.90 1xck h THR 500 Ca 0.04 -0.39 0.04 0.00 0.77 0.00 0.00 66.41 66.87 1xck h THR 500 Cb 0.82 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 68.30 1xck h THR 500 CO 0.06 0.12 0.05 -0.09 0.37 0.00 0.00 175.52 176.04 1xck h ARG 501 N 0.12 0.15 0.25 6.66 2.43 -1.21 -1.57 114.38 121.21 1xck h ARG 501 Ca 0.05 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1xck h ARG 501 Cb 0.13 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1xck h ARG 501 CO -0.01 0.10 -0.12 0.77 -1.51 0.00 0.00 179.97 179.20 1xck h SER 502 N 0.15 -0.29 -0.56 -3.80 0.02 -0.82 -1.00 113.55 107.26 1xck h SER 502 Ca 0.14 -0.00 0.11 0.00 -0.84 0.00 0.00 61.79 61.19 1xck h SER 502 Cb 0.15 0.07 -0.09 0.00 0.14 0.00 0.00 62.40 62.68 1xck h SER 502 CO -0.19 -0.19 0.04 0.00 -1.14 0.00 0.00 176.83 175.35 1xck h ALA 503 N 0.39 0.58 0.25 3.77 0.00 -0.53 0.60 119.26 124.32 1xck h ALA 503 Ca -0.03 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xck h ALA 503 Cb 0.27 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xck h ALA 503 CO 0.06 -0.36 -0.12 1.25 0.00 0.00 0.00 179.25 180.07 1xck h LEU 504 N 0.16 -0.28 -0.71 0.00 5.85 -1.09 -1.23 115.31 118.00 1xck h LEU 504 Ca 0.29 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1xck h LEU 504 Cb 0.44 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 1xck h LEU 504 CO -0.44 -0.04 0.44 1.56 -0.34 0.00 0.00 178.44 179.62 1xck h GLN 505 N -0.52 0.83 -0.47 1.25 4.20 -0.82 -0.11 115.11 119.47 1xck h GLN 505 Ca -0.03 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.53 1xck h GLN 505 Cb 0.39 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1xck h GLN 505 CO 0.06 0.55 -0.09 1.88 -0.67 0.00 0.00 178.83 180.56 1xck h TYR 506 N 0.85 0.99 0.39 2.96 0.05 -0.87 -1.28 116.97 120.06 1xck h TYR 506 Ca 0.29 -0.20 -0.02 0.00 0.05 0.00 0.00 58.73 58.85 1xck h TYR 506 Cb 0.05 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.55 1xck h TYR 506 CO -0.04 0.96 -0.19 0.00 -1.05 0.00 0.00 178.16 177.84 1xck h ALA 507 N 0.89 -0.52 -0.48 3.88 0.00 -0.86 -2.28 119.26 119.88 1xck h ALA 507 Ca 0.12 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1xck h ALA 507 Cb 0.63 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1xck h ALA 507 CO 0.04 -0.74 0.34 0.00 0.00 0.00 0.00 179.25 178.89 1xck h ALA 508 N -0.04 2.24 0.67 0.00 0.00 -1.01 -0.68 119.26 120.44 1xck h ALA 508 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1xck h ALA 508 Cb 0.46 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1xck h ALA 508 CO 0.09 -0.36 -0.32 1.03 0.00 0.00 0.00 179.25 179.68 1xck h SER 509 N 0.16 -0.76 -0.19 0.00 0.87 -0.68 0.47 113.55 113.42 1xck h SER 509 Ca 0.23 -0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.70 1xck h SER 509 Cb 0.69 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.83 1xck h SER 509 CO -0.03 -0.43 -0.14 1.62 -0.53 0.00 0.00 176.83 177.32 1xck h VAL 510 N -1.10 1.24 -0.56 2.23 3.04 -1.15 -2.22 116.25 117.73 1xck h VAL 510 Ca -0.09 -1.10 -0.03 0.00 -1.01 0.00 0.00 66.70 64.47 1xck h VAL 510 Cb 0.73 1.14 -0.03 0.00 -2.01 0.00 0.00 31.29 31.12 1xck h VAL 510 CO 0.15 0.36 0.24 0.00 -1.01 0.00 0.00 177.57 177.32 1xck h ALA 511 N 1.32 0.73 -0.85 3.17 0.00 -1.11 -1.65 119.26 120.87 1xck h ALA 511 Ca 0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xck h ALA 511 Cb 0.55 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1xck h ALA 511 CO 0.03 0.32 0.48 0.78 0.00 0.00 0.00 179.25 180.86 1xck h GLY 512 N 0.77 1.26 0.93 0.00 0.00 -0.57 -1.85 103.07 103.61 1xck h GLY 512 Ca 0.19 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1xck h GLY 512 CO -0.02 0.53 0.14 1.41 0.00 0.00 0.00 176.54 178.60 1xck h LEU 513 N 1.18 0.49 -0.32 3.11 3.38 -0.86 -2.74 115.31 119.56 1xck h LEU 513 Ca 0.30 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1xck h LEU 513 Cb 0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1xck h LEU 513 CO -0.05 0.53 0.07 0.24 0.09 0.00 0.00 178.44 179.32 1xck h MET 514 N 0.42 0.52 -0.40 1.13 2.86 -1.13 -2.51 114.93 115.83 1xck h MET 514 Ca 0.12 -0.13 0.10 0.00 -2.06 0.00 0.00 59.70 57.73 1xck h MET 514 Cb 0.20 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 1xck h MET 514 CO -0.01 0.60 0.28 0.82 1.06 0.00 0.00 176.91 179.66 1xck h ILE 515 N 0.36 0.83 -0.90 -1.22 2.04 -1.30 -0.79 117.51 116.54 1xck h ILE 515 Ca 0.10 -0.02 -0.45 0.00 1.00 0.00 0.00 64.86 65.48 1xck h ILE 515 Cb 0.32 0.77 -0.27 0.00 -0.74 0.00 0.00 36.82 36.89 1xck h ILE 515 CO 0.00 0.01 0.54 0.35 0.00 0.00 0.00 178.15 179.05 1xck n THR 516 N -4.43 3.11 -4.09 -0.27 -2.24 -0.96 -4.82 114.28 100.56 1xck n THR 516 Ca 0.06 -2.01 -0.35 0.00 -2.27 0.00 0.00 64.05 59.48 1xck n THR 516 Cb 0.43 -0.44 -0.10 0.00 -2.10 0.00 0.00 70.33 68.13 1xck n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xck s THR 517 N -3.27 4.69 -0.06 4.28 2.01 -0.30 -4.97 115.64 118.01 1xck s THR 517 Ca 0.55 -0.08 0.05 0.00 0.31 0.00 0.00 61.69 62.53 1xck s THR 517 Cb 0.47 -3.08 -0.08 0.00 0.01 0.00 0.00 72.50 69.82 1xck s THR 517 CO 0.10 0.50 0.14 -0.62 -0.69 0.00 0.00 174.62 174.05 1xck n GLU 518 N 3.15 1.28 -3.84 4.92 -0.58 -1.26 -4.82 120.64 119.49 1xck n GLU 518 Ca -0.17 -0.04 -0.12 0.00 -0.42 0.00 0.00 57.16 56.41 1xck n GLU 518 Cb 0.53 -1.04 -0.11 0.00 -0.57 0.00 0.00 31.44 30.24 1xck n GLU 518 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xck s MET 520 N -0.66 1.00 -0.13 0.00 -1.94 -0.43 -5.00 119.30 112.14 1xck s MET 520 Ca -0.08 -0.22 0.02 0.00 -1.71 0.00 0.00 55.69 53.71 1xck s MET 520 Cb -0.04 -0.93 0.01 0.00 2.01 0.00 0.00 34.83 35.87 1xck s MET 520 CO 0.01 -0.00 -0.21 0.08 -0.01 0.00 0.00 175.02 174.89 1xck s VAL 521 N 0.63 1.94 0.27 -6.03 1.01 -1.26 -1.26 120.40 115.69 1xck s VAL 521 Ca -0.10 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 60.97 1xck s VAL 521 Cb -0.13 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1xck s VAL 521 CO 0.01 0.53 0.28 0.28 0.00 0.00 0.00 175.10 176.19 1xck s THR 522 N 0.83 0.00 0.67 3.92 -1.32 -0.92 -4.99 115.64 113.83 1xck s THR 522 Ca -0.08 -1.86 -0.11 0.00 -1.21 0.00 0.00 61.69 58.44 1xck s THR 522 Cb -0.15 -2.49 -0.01 0.00 -1.51 0.00 0.00 72.50 68.34 1xck s THR 522 CO -0.01 0.00 1.05 -1.81 -2.21 0.00 0.00 174.62 171.64 1xck s ASP 523 N -3.22 5.66 0.07 8.08 1.11 -1.26 -0.33 116.67 126.78 1xck s ASP 523 Ca 0.36 1.48 -0.30 0.00 0.18 0.00 0.00 52.55 54.27 1xck s ASP 523 Cb 0.03 -2.41 -0.05 0.00 1.07 0.00 0.00 42.92 41.56 1xck s ASP 523 CO 0.18 -1.25 1.04 -0.22 1.18 0.00 0.00 175.17 176.10 1xck s LEU 524 N -5.40 4.43 0.00 1.23 2.96 -1.18 -4.47 118.68 116.24 1xck s LEU 524 Ca 0.57 1.84 0.00 0.00 -0.22 0.00 0.00 54.13 56.32 1xck s LEU 524 Cb -0.13 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.98 1xck s LEU 524 CO 0.54 -0.24 0.23 -0.81 -1.32 0.00 0.00 176.35 174.75